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

*Links on SpectraBase are not permalinks.

BENZENE, 1-BUTYL-2-ETHYNYL-

View entire compound with spectra: 2 MS (GC)

BENZENE, 1-BUTYL-2-ETHYNYL-
SpectraBase Compound ID JiHebWupLg4
InChI InChI=1S/C12H14/c1-3-5-8-12-10-7-6-9-11(12)4-2/h2,6-7,9-10H,3,5,8H2,1H3
InChIKey IWUYGNNJLPBXAV-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C12H14
Exact Mass 158.10955 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 8paD64xQyEU
Name BENZENE, 1-BUTYL-2-ETHYNYL-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 158.109550451 u
Formula C12H14
InChI InChI=1S/C12H14/c1-3-5-8-12-10-7-6-9-11(12)4-2/h2,6-7,9-10H,3,5,8H2,1H3
InChIKey IWUYGNNJLPBXAV-UHFFFAOYSA-N
Molecular Weight 158.244 g/mol
Nominal Mass 158 u
Number of Peaks 100
SMILES c1(ccccc1CCCC)C#C
SPLASH splash10-00mo-8900000000-48f5401d68e0979580a0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX001511