(E)-3-penten-2-one (Q27161739)

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chemical compound

• (3E)-pent-3-en-2-one
• (3E)-3-Penten-2-one
• (E)-3-Penten-2-one
• FEMA No. 3417

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Language	Label	Description	Also known as
English	(E)-3-penten-2-one	chemical compound	(3E)-pent-3-en-2-one (3E)-3-Penten-2-one (E)-3-Penten-2-one FEMA No. 3417

Statements

instance of

type of chemical entity

0 references

subclass of

oxygenated hydrocarbon

0 references

(EZ)-3-Penten-2-one

1 reference

based on heuristic

inferred from SMILES

chemical structure

Structural formula of (E)-3-Penten-2-one.svg
268 × 113; 6 KB

0 references

mass

84.058±0 dalton

1 reference

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

9 October 2016

chemical formula

C₅H₈O

1 reference

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

18 November 2016

canonical SMILES

CC=CC(=O)C

1 reference

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

18 November 2016

isomeric SMILES

C/C=C/C(=O)C

1 reference

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

18 November 2016

found in taxon

Tamarindus indica

1 reference

stated in

Volatile Flavor Components of Tamarind (Tamarindus indicaL.)

Cichorium endivia

1 reference

stated in

Neutral volatiles from blended endive (Cichorium endivia, L.)

Mangifera indica

1 reference

stated in

Volatile components from mango (Mangifera indica L.) cultivars

Nicotiana tabacum

1 reference

stated in

Comparison of different extraction methods: steam distillation, simultaneous distillation and extraction and headspace co-distillation, used for the analysis of the volatile components in aged flue-cured tobacco leaves

Arctostaphylos uva-ursi

1 reference

stated in

Comparative study of the leaf volatiles of Arctostaphylos uva-ursi (L.) Spreng. and Vaccinium vitis-idaea L. (Ericaceae).

Identifiers

InChI

InChI=1S/C5H8O/c1-3-4-5(2)6/h3-4H,1-2H3/b4-3+

1 reference

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

18 November 2016

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

1 reference

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

18 November 2016

CAS Registry Number

3102-33-8

1 reference

stated in

Global Substance Registration System

UNII

4WN5NGB7KX

language of work or name

English

title

3-penten-2-one (English)

retrieved

18 November 2016

ChemSpider ID

553493

1 reference

stated in

ChemSpider

ChemSpider ID

553493

language of work or name

English

title

(E)-3-Penten-2-one (English)

retrieved

9 October 2016

PubChem CID

637920

2 references

stated in

PubChem

PubChem CID

637920

language of work or name

English

title

Methyl propenyl ketone (English)

retrieved

18 November 2016

matched by identifier from

InChIKey

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

ChEBI ID

145276

mapping relation type

exact match

2 references

stated in

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C5H8O/c1-3-4-5(2)6/h3-4H,1-2H3/b4-3+

UniChem compound ID

2936580

1 reference

stated in

UniChem

SPLASH

splash10-0006-9000000000-39b3225b4599f0b9fece

0 references

splash10-0159-9000000000-bc23095f98a3d62d8edd

0 references

NMRShiftDB structure ID

20041831

1 reference

matched by identifier from

InChIKey

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

DSSTox substance ID

DTXSID90881229

1 reference

matched by identifier from

InChIKey

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

DSSTOX compound identifier

DTXCID30210817

0 references

Human Metabolome Database ID

HMDB0001184

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

KNApSAcK ID

C00061375

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

UNII

4WN5NGB7KX

2 references

stated in

Global Substance Registration System

UNII

4WN5NGB7KX

language of work or name

English

title

3-penten-2-one (English)

retrieved

18 November 2016

matched by identifier from

InChIKey

InChIKey

LABTWGUMFABVFG-ONEGZZNKSA-N

LIPID MAPS ID

LMFA12000028

1 reference

stated in

LIPID MAPS

reference URL

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

retrieved

30 June 2018

 

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Wikivoyage(0 entries)

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Wiktionary(0 entries)

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