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

*Links on SpectraBase are not permalinks.
3-Cyano-2-(4-phenylbuta-1,3-diyn-1-yl)-1-methylcyclobutene
SpectraBase Compound ID 7mkUlrGimil
InChI InChI=1S/C16H11N/c1-13-11-15(12-17)16(13)10-6-5-9-14-7-3-2-4-8-14/h2-4,7-8,15H,11H2,1H3
InChIKey JFOVZBHWHFNNFX-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C16H11N
Exact Mass 217.089149 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 9n8lQFVw81H
Name 3-Cyano-2-(4-phenylbuta-1,3-diyn-1-yl)-1-methylcyclobutene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11N
InChI InChI=1S/C16H11N/c1-13-11-15(12-17)16(13)10-6-5-9-14-7-3-2-4-8-14/h2-4,7-8,15H,11H2,1H3
InChIKey JFOVZBHWHFNNFX-UHFFFAOYSA-N
Molecular Weight 217.271 g/mol
SMILES C1(=C(C)CC1C#N)C#CC#Cc1ccccc1
SPLASH splash10-03di-0940000000-cf599b77f78a9cadfb7b
Source of Spectrum AT-34-2146-3
Synonyms 3-methyl-2-(4-phenyl-1,3-butadiynyl)-2-cyclobutene-1-carbonitrile
Wiley ID 852474