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

*Links on SpectraBase are not permalinks.
5-[E-1-Nitropropen-2-yl]-2,3-dimethylindole
SpectraBase Compound ID qbsH8WqIvX
InChI InChI=1S/C13H14N2O2/c1-8(15(16)17)6-11-4-5-13-12(7-11)9(2)10(3)14-13/h4-7,14H,1-3H3/b8-6+
InChIKey XAPQEMAYUFLVPZ-SOFGYWHQSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 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 IoGkpsFdK4W
Name 5-[E-1-Nitropropen-2-yl]-2,3-dimethylindole
CAS Registry Number 70447-60-8
Comments Edited after expert review - Original record with SpectrumID 1231796 removed
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-8(15(16)17)6-11-4-5-13-12(7-11)9(2)10(3)14-13/h4-7,14H,1-3H3/b8-6+
InChIKey XAPQEMAYUFLVPZ-SOFGYWHQSA-N
Molecular Weight 230.267 g/mol
SMILES [nH]1c(c(c2cc(ccc12)\C=C/(N(=O)=O)C)C)C
SPLASH splash10-00l2-9520000000-be44a548633ec5866b81
Source of Spectrum SS-3-66-0
Synonyms 2,3-Dimethyl-5-[(1E)-2-nitro-1-propenyl]-1H-indole 5-(e-2-nitropropenyl)-2,3-dimethylindole
Wiley ID 1718209