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Benzenethiol, 2-[[(1-methylethyl)amino]methyl]-4-nitro-
SpectraBase Compound ID Cw8xWYZDR5C
InChI InChI=1S/C10H14N2O2S/c1-7(2)11-6-8-5-9(12(13)14)3-4-10(8)15/h3-5,7,11,15H,6H2,1-2H3
InChIKey NGSQXOFQURMAJI-UHFFFAOYSA-N
Mol Weight 226.29 g/mol
Molecular Formula C10H14N2O2S
Exact Mass 226.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Ncl2PRiQlI
Name Benzenethiol, 2-[[(1-methylethyl)amino]methyl]-4-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14N2O2S
InChI InChI=1S/C10H14N2O2S/c1-7(2)11-6-8-5-9(12(13)14)3-4-10(8)15/h3-5,7,11,15H,6H2,1-2H3
InChIKey NGSQXOFQURMAJI-UHFFFAOYSA-N
Molecular Weight 226.294 g/mol
SMILES N(C(C)C)Cc1c(ccc(c1)[N+]([O-])=O)S
SPLASH splash10-0006-9410000000-576cb8563d45e52d3beb
Source of Spectrum JX-2015-0-710
Synonyms 2-((Isopropylamino)methyl)-4-nitrobenzenethiol 4-Nitro-2-[(propan-2-ylamino)methyl]benzenethiol
Wiley ID 1720621