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

*Links on SpectraBase are not permalinks.

methyl 5-phenylpent-2-ynoate

View entire compound with spectra: 1 MS (GC)

methyl 5-phenylpent-2-ynoate
SpectraBase Compound ID DlgrLiNkgPC
InChI InChI=1S/C12H12O2/c1-14-12(13)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8H,5,9H2,1H3
InChIKey DDVOVTHMBTWNNK-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 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 CMI81rHeAVm
Name methyl 5-phenylpent-2-ynoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.083729624 u
Formula C12H12O2
GC Column HP-5
GC Oven Program Oven temp 300oC
InChI InChI=1S/C12H12O2/c1-14-12(13)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8H,5,9H2,1H3
InChIKey DDVOVTHMBTWNNK-UHFFFAOYSA-N
Instrument Name GC-MS Agilent 5977B MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201800526
Molecular Weight 188.226 g/mol
Quality 92
Reported Formula C12H12O2
SMILES COC(C#CCCC1=CC=CC=C1)=O
SPLASH splash10-0006-9400000000-08d94937d0b9d7ca2a3b
Source of Spectrum QE-24-SM12-3u (DOI: 10.1002/chem.201800526)
Wiley ID 1900220