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

*Links on SpectraBase are not permalinks.
2-Octynoic acid,ethyl ester
SpectraBase Compound ID FkQlcnYRXft
InChI InChI=1S/C10H16O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-7H2,1-2H3
InChIKey QPMDWYXUSMRVKT-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 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 1rYJEDi1ZI
Name 2-Octynoic acid, ethyl ester
Alternate Name(s) Ethyl 2-octynate Ethyl 2-octynoate Ethyl heptine carbonate Ethyl heptyne carboxylate Ethyl oct-2-ynoate Oct-2-ynoic acid ethyl ester AI3-35774 EINECS 234-058-5
CAS Registry Number 10519-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-7H2,1-2H3
InChIKey QPMDWYXUSMRVKT-UHFFFAOYSA-N
Molecular Weight 168.236 g/mol
SMILES C(CC#CC(=O)OCC)CCC
SPLASH splash10-05xs-9200000000-53d52804fa466839067a
Source of Spectrum VC-1981-834-0
Wiley ID 1164512