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1-Methyl-4-(1-nitromethyl-ethyl)-benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-Methyl-4-(1-nitromethyl-ethyl)-benzene
SpectraBase Compound ID DASJ569m0Il
InChI InChI=1S/C10H13NO2/c1-8-3-5-10(6-4-8)9(2)7-11(12)13/h3-6,9H,7H2,1-2H3
InChIKey LRPZNDFDHREQEK-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zTC2EIrTTG
Name 2-(p-Tolyl)-3-nitropropane
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-8-3-5-10(6-4-8)9(2)7-11(12)13/h3-6,9H,7H2,1-2H3
InChIKey LRPZNDFDHREQEK-UHFFFAOYSA-N
Molecular Weight 179.219 g/mol
SMILES C(N(=O)=O)C(c1ccc(cc1)C)C
SPLASH splash10-03gi-0900000000-d0e66b148e360fa97041
Source of Spectrum SK-29-874-6
Synonyms 1-Methyl-4-(1-methyl-2-nitroethyl)benzene 1-Methyl-4-(1-nitropropan-2-yl)benzene
Wiley ID 880480