(Q81990973)

English

3-Hexen-2-one, 5-methyl-

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

biogenic acyclic ketone

0 references

mass

112.088815004 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₇H₁₂O

0 references

canonical SMILES

O=C(C=CC(C)C)C

0 references

found in taxon

Cryptomeria japonica

1 reference

stated in

GC/MS Analysis of the Leaf Oil ofCryptomeria japonicaD. Don from Reunion Island

Identifiers

InChI

InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3

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InChIKey

IYMKNYVCXUEFJE-UHFFFAOYSA-N

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CAS Registry Number

5166-53-0

1 reference

InChIKey

IYMKNYVCXUEFJE-UHFFFAOYSA-N

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=5166-53-0

2 references

26 December 2021

matched by identifier from

InChIKey

IYMKNYVCXUEFJE-UHFFFAOYSA-N

1 reference

1 reference

matched by identifier from

InChIKey

IYMKNYVCXUEFJE-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID1041051

0 references

FL number

07.106

1 reference

quotation

CAS no.: 5166-53-0 (English)

23 January 2021

07.106

1132

1 reference

stated in

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)

retrieved

13 May 2021

(Q81990973)

3-Hexen-2-one, 5-methyl-

Statements

Identifiers

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