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1-Methyl-4-nitro-5-(phenylsulfonyl)imidazole
SpectraBase Compound ID 1hfA8qI29mB
InChI InChI=1S/C10H9N3O4S/c1-12-7-11-9(13(14)15)10(12)18(16,17)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey RROUABPKRUXIBP-UHFFFAOYSA-N
Mol Weight 267.26 g/mol
Molecular Formula C10H9N3O4S
Exact Mass 267.031377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYbi2m9treY
Name 1-Methyl-4-nitro-5-(phenylsulfonyl)imidazole
CAS Registry Number 80348-54-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9N3O4S
InChI InChI=1S/C10H9N3O4S/c1-12-7-11-9(13(14)15)10(12)18(16,17)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey RROUABPKRUXIBP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200800022
Molecular Weight 267.259 g/mol
SMILES c1[n](c(c(n1)[N+](=O)[O-])S(c1ccccc1)(=O)=O)C
SPLASH splash10-005c-9210000000-9e33e73bd56fe724ea17
Source of Spectrum APC-341-500-5
Synonyms 5-(benzenesulfonyl)-1-methyl-4-nitro-imidazole 1-Methyl-4-nitro-5-(phenylsulfonyl)-1H-imidazole 5-Besyl-1-methyl-4-nitro-imidazole 5-(benzenesulfonyl)-1-methyl-4-nitroimidazole
Wiley ID 1768947