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1-(4-Methylsulfonylphenyl)-2-nitroprop-1-ene
SpectraBase Compound ID GpRLejy3nKa
InChI InChI=1S/C10H11NO4S/c1-8(11(12)13)7-9-3-5-10(6-4-9)16(2,14)15/h3-7H,1-2H3/b8-7-
InChIKey KYNRPCVREMUPNG-FPLPWBNLSA-N
Mol Weight 241.26 g/mol
Molecular Formula C10H11NO4S
Exact Mass 241.040879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Gd8tttWbGy
Name 1-(4-Methylsulfonylphenyl)-2-nitroprop-1-ene
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 241.040879008 u
Formula C10H11NO4S
InChI InChI=1S/C10H11NO4S/c1-8(11(12)13)7-9-3-5-10(6-4-9)16(2,14)15/h3-7H,1-2H3/b8-7-
InChIKey KYNRPCVREMUPNG-FPLPWBNLSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 241.261 g/mol
Nominal Mass 241 u
Quality 985
Retention Index 2202
SMILES C=1(S(=O)(=O)C)C=CC(=CC1)\C=C\([N+](=O)[O-])C
SPLASH splash10-0159-3900000000-c09c34ec3b3e280db0e3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(methylsulfonyl)-4-(2-nitroprop-1-en-1-yl)benzene
Technique GC/MS
Wiley ID DD2024_005469