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

*Links on SpectraBase are not permalinks.
1-Isocyanato-2-(4-nitrophenylethynyl)benzene
SpectraBase Compound ID 5XaaQfMED9X
InChI InChI=1S/C15H8N2O3/c18-11-16-15-4-2-1-3-13(15)8-5-12-6-9-14(10-7-12)17(19)20/h1-4,6-7,9-10H
InChIKey HLCSXIPRNFIATE-UHFFFAOYSA-N
Mol Weight 264.24 g/mol
Molecular Formula C15H8N2O3
Exact Mass 264.053492 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 LWczRgG09Gg
Name 1-Isocyanato-2-(4-nitrophenylethynyl)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8N2O3
InChI InChI=1S/C15H8N2O3/c18-11-16-15-4-2-1-3-13(15)8-5-12-6-9-14(10-7-12)17(19)20/h1-4,6-7,9-10H
InChIKey HLCSXIPRNFIATE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol9014877
Molecular Weight 264.240 g/mol
SMILES c1cc(C#Cc2ccc(cc2)[N+](=O)[O-])c(N=C=O)cc1
SPLASH splash10-03di-1390000000-c5b4b5af56ea8fd21ad1
Source of Spectrum A1-11-4262/SMS15-1k
Synonyms 1-Isocyanato-2-((4-nitrophenyl)ethynyl)benzene
Wiley ID 1757158