(Q27261148)

Sorbyl acetate (English)

14 October 2016

chemical formula

C₈H₁₂O₂

1 reference

Sorbyl acetate (English)

14 October 2016

canonical SMILES

CC=CC=CCOC(=O)C

1 reference

Sorbyl acetate (English)

14 October 2016

isomeric SMILES

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

1 reference

Sorbyl acetate (English)

InChI=1S/C8H12O2/c1-3-4-5-6-7-10-8(2)9/h3-6H,7H2,1-2H3/b4-3+,6-5+

14 October 2016

Identifiers

InChI

1 reference

Sorbyl acetate (English)

PXVKYPFROMBALG-VNKDHWASSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

Sorbyl acetate (English)

14 October 2016

2 references

sorbyl acetate (English)

PXVKYPFROMBALG-VNKDHWASSA-N

14 October 2016

InChIKey

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=57006-69-6

1 reference

(2E,4E)-2,4-Hexadienyl acetate (English)

14 October 2016

1 reference

Sorbyl acetate (English)

MSBNK-Fac_Eng_Univ_Tokyo-JP007073

14 October 2016

ChEBI ID

194509

mapping relation type

exact match

1 reference

stated in

ChEBI release 2022-06-13

1 reference

MassBank accession ID

0 references

SPLASH

splash10-0006-9000000000-f433eb484f94ecf93aba

0 references

EC number

216-163-8

1 reference

stated in

Global Substance Registration System

sorbyl acetate (English)

Human Metabolome Database ID

14 October 2016

HMDB0032311

1 reference

based on heuristic

inferred from InChIKey

Global Substance Registration System

1 reference

stated in

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

sorbyl acetate (English)

14 October 2016

1 reference