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

*Links on SpectraBase are not permalinks.
1-(Azulen-1-yl)hept-2-yn-1-one
SpectraBase Compound ID 2BcvGFlzbfA
InChI InChI=1S/C17H16O/c1-2-3-4-8-11-17(18)16-13-12-14-9-6-5-7-10-15(14)16/h5-7,9-10,12-13H,2-4H2,1H3
InChIKey PNTIYCGMWFZGKD-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C17H16O
Exact Mass 236.120115 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 4JhrFYmlrqr
Name 1-(Azulen-1-yl)hept-2-yn-1-one
Appearance Dark red oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O
InChI InChI=1S/C17H16O/c1-2-3-4-8-11-17(18)16-13-12-14-9-6-5-7-10-15(14)16/h5-7,9-10,12-13H,2-4H2,1H3
InChIKey PNTIYCGMWFZGKD-UHFFFAOYSA-N
Instrument Name Finnigen MAT 200
Ionization Type EI+
Literature Reference DOI 10.3762/bjoc.7.136
Molecular Weight 236.314 g/mol
SMILES c12c(ccccc2)c(cc1)C(C#CCCCC)=O
SPLASH splash10-0179-0940000000-f3eea9a1ba21fc5c0d2d
Source of Spectrum BJO-7-SM7-3b
Wiley ID 1867030