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

*Links on SpectraBase are not permalinks.
2-(5-Methyl-7-nitro-2,3-dihydroindol-1-yl)benzenecarbonitrile
SpectraBase Compound ID 55dMKTH6Mp8
InChI InChI=1S/C16H13N3O2/c1-11-8-12-6-7-18(16(12)15(9-11)19(20)21)14-5-3-2-4-13(14)10-17/h2-5,8-9H,6-7H2,1H3
InChIKey LTRHCBWSNJVKBE-UHFFFAOYSA-N
Mol Weight 279.3 g/mol
Molecular Formula C16H13N3O2
Exact Mass 279.100777 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 Jin3PvNgZTU
Name 2-(5-Methyl-7-nitro-2,3-dihydroindol-1-yl)benzenecarbonitrile
CAS Registry Number 116707-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3O2
InChI InChI=1S/C16H13N3O2/c1-11-8-12-6-7-18(16(12)15(9-11)19(20)21)14-5-3-2-4-13(14)10-17/h2-5,8-9H,6-7H2,1H3
InChIKey LTRHCBWSNJVKBE-UHFFFAOYSA-N
Molecular Weight 279.299 g/mol
SMILES c12N(CCc1cc(cc2N(=O)=O)C)c1c(C#N)cccc1
SPLASH splash10-0059-0090000000-6dee1ef75abca2a5c950
Source of Spectrum Y-24-1603-12
Synonyms 2-(5-Methyl-7-nitro-2,3-dihydroindol-1-yl)benzonitrile 2-(5-Methyl-7-nitro-indolin-1-yl)benzonitrile
Wiley ID 1283011