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

*Links on SpectraBase are not permalinks.
2-Methyl-3-[2-nitro-1-(nitromethyl)ethyl]-1H-indole
SpectraBase Compound ID G9PeRuVo9Fh
InChI InChI=1S/C12H13N3O4/c1-8-12(9(6-14(16)17)7-15(18)19)10-4-2-3-5-11(10)13-8/h2-5,9,13H,6-7H2,1H3
InChIKey OZHYPXWODJIQMS-UHFFFAOYSA-N
Mol Weight 263.25 g/mol
Molecular Formula C12H13N3O4
Exact Mass 263.090606 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 5KWVnOMXYy8
Name 2-Methyl-3-[2-nitro-1-(nitromethyl)ethyl]-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O4
InChI InChI=1S/C12H13N3O4/c1-8-12(9(6-14(16)17)7-15(18)19)10-4-2-3-5-11(10)13-8/h2-5,9,13H,6-7H2,1H3
InChIKey OZHYPXWODJIQMS-UHFFFAOYSA-N
Molecular Weight 263.253 g/mol
SMILES [nH]1c2c(c(c1C)C(CN(=O)=O)CN(=O)=O)cccc2
SPLASH splash10-08mi-0960000000-e2b6834dd090143953c4
Source of Spectrum D8-327-109-3
Synonyms 3-(1,3-dinitropropan-2-yl)-2-methyl-1H-indole
Wiley ID 1515105