4-methylbenzaldehyde (Q3266675)

CC1=CC=C(C=C1)C=O

2 references

−6.0 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

rooibos

1 reference

Volatile components of Rooibos tea (Aspalathus linearis)

Tanacetum parthenium

1 reference

The Essential Oil ofTanacetum parthenium (L.) Schultz-Bip.

Artemisia minor

1 reference

Chemical constituents from the aerial parts of Artemisia minor.

Carum carvi

1 reference

Carvone and limonene in caraway fruits (Carum carvi L.) analyzed by supercritical carbon dioxide extraction-gas chromatography

Cichorium endivia

1 reference

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

Gossypium hirsutum

1 reference

Survey of the volatile constituents of cotton lint and waste with regard to byssinosis

Homo sapiens

1 reference

The human saliva metabolome

Dactylanthus taylorii

1 reference

Volatile constituents of Dactylanthus taylorii flower nectar in relation to flower pollination and browsing by animals

Mangifera indica

1 reference

Volatile components from mango (Mangifera indica L.) cultivars

Arabidopsis thaliana

1 reference

Universally occurring phenylpropanoid and species-specific indolic metabolites in infected and uninfected Arabidopsis thaliana roots and leaves.

Nicotiana tabacum

1 reference

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

tomato

1 reference

Relationships between the volatile compounds evaluated by solid phase microextraction and the thermal treatment of tomato juice: optimization of the blanching parameters

Identifiers

InChI

InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3

1 reference

PubChem

2 references

PubChem

ChEBI release 2020-09-01

CAS Registry Number

104-87-0

1 reference

https://commonchemistry.cas.org/detail?cas_rn=104-87-0

8 April 2021

ChemSpider ID

13865424

1 reference

PubChem CID

7725

2 references

Reaxys registry number

385772

0 references

Gmelin number

27123

0 references

ChEBI ID

28617

mapping relation type

exact match

2 references

International Chemical Identifier

InChI

InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3

ChEMBL ID

CHEMBL190927

1 reference

2 references

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP000176

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008787

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP004986

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008704

0 references

SPLASH

splash10-01bc-8900000000-cc469f3657d6fab4bdef

0 references

splash10-01bc-9700000000-ff0e14ae428ad7d54394

0 references

splash10-00r6-9500000000-8499fc6c52a970ddef6f

0 references

splash10-01bc-9700000000-1039b386245d6043345a

0 references

NMRShiftDB structure ID

9674

1 reference

Hazardous Substances Data Bank

0 references

1 reference

28 October 2019

4-METHYLBENZALDEHYDE (English)

10 May 2021

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

0 references

0 references

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.002.952

retrieved

27 December 2018

title

p-tolualdehyde (English)

ECHA Substance Infocard ID

CAS no.: 104-87-0 (English)

100.002.952

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.002.952

retrieved

27 December 2018

title

p-tolualdehyde (English)

CAS no.: 104-87-0 (English)

FL number

05.029

1 reference

CAS no.: 104-87-0 (English)

23 January 2021

05.029

1 reference

28 December 2019

4-METHYLBENZALDEHYDE (English)

Human Metabolome Database ID

CAS no.: 104-87-0 (English)

UM-BBD compound ID

c0201

0 references

HMDB0029638

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00047546

2 references

based on heuristic

inferred from InChIKey

UNII

GAX22QZ28Q

1 reference

0 references

1 reference