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(Q115785578)
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English
(2S)-hexan-2-ol
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
2-hexanol
1 reference
based on heuristic
inferred from InChIKey
mass
102.104465068
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₆H₁₄O
0 references
canonical SMILES
OC(C)CCCC
0 references
isomeric SMILES
CCCC[C@H](C)O
0 references
found in taxon
Mangifera indica
1 reference
stated in
Cultivar relationships in mango based on fruit volatile profiles
Carica papaya
1 reference
stated in
Volatile components of papaya (Carica papaya L., Solo variety)
Prunus avium
1 reference
stated in
Free and glycosidically bound aroma compounds in cherry (Prunus avium L.).
Identifiers
InChI
InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3/t6-/m0/s1
0 references
InChIKey
QNVRIHYSUZMSGM-LURJTMIESA-N
0 references
PubChem CID
638097
1 reference
stated in
PubChem
retrieved
21 December 2022
based on heuristic
inferred from InChIKey
SureChEMBL ID
SCHEMBL566846
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QNVRIHYSUZMSGM-LURJTMIESA-N
UniChem compound ID
16633168
1 reference
stated in
UniChem
UNII
JM3G4T9YH9
1 reference
matched by identifier from
InChIKey
InChIKey
QNVRIHYSUZMSGM-LURJTMIESA-N
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