For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Butenoic acid, octyl ester
SpectraBase Compound ID LjsU83uTVjx
InChI InChI=1S/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h4,10H,3,5-9,11H2,1-2H3/b10-4+
InChIKey HULBECQFWZPEBI-ONNFQVAWSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID A6V6iVp9ClN
Name 2-Butenoic acid, octyl ester
CAS Registry Number 22874-79-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h4,10H,3,5-9,11H2,1-2H3/b10-4+
InChIKey HULBECQFWZPEBI-ONNFQVAWSA-N
Molecular Weight 198.306 g/mol
SMILES CCCCCCCCOC(=O)\C=C\C
SPLASH splash10-014u-9000000000-d9c0f45a8711a967906e
Source of Spectrum RB-1982-11093-0
Synonyms Crotonic acid, octyl ester (E)-2-butenoic acid octyl ester Octyl (2E)-but-2-enoate (E)-but-2-enoic acid octyl ester Octyl (E)-but-2-enoate (E)-Octyl but-2-enoate Octyl 2-butenoate Octyl crotonate AI3-06057 EINECS 245-279-1 NSC 67892
Wiley ID 1195777