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1-[(4-Methylphenyl)sulfonyl]-4,6-dinitroindoline
SpectraBase Compound ID 4JqVqAAWJqR
InChI InChI=1S/C15H13N3O6S/c1-10-2-4-12(5-3-10)25(23,24)16-7-6-13-14(16)8-11(17(19)20)9-15(13)18(21)22/h2-5,8-9H,6-7H2,1H3
InChIKey ICMUKAOBIWFYGK-UHFFFAOYSA-N
Mol Weight 363.34 g/mol
Molecular Formula C15H13N3O6S
Exact Mass 363.052506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DvgmtmguOC
Name 1-[(4-Methylphenyl)sulfonyl]-4,6-dinitroindoline
Alternate Name(s) 1-(4-Methylphenyl)sulfonyl-4,6-dinitro-2,3-dihydroindole 4,6-Dinitro-1-(p-tolylsulfonyl)indoline 4,6-Dinitro-1-tosyl-indoline Indole, 2,3-dihydro-1-(4-methylphenylsulfonyl)-4,6-diinitro-
CAS Registry Number 312513-83-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3O6S
InChI InChI=1S/C15H13N3O6S/c1-10-2-4-12(5-3-10)25(23,24)16-7-6-13-14(16)8-11(17(19)20)9-15(13)18(21)22/h2-5,8-9H,6-7H2,1H3
InChIKey ICMUKAOBIWFYGK-UHFFFAOYSA-N
Molecular Weight 363.344 g/mol
SMILES c1(cc(c2c(c1)N(CC2)S(=O)(c1ccc(cc1)C)=O)N(=O)=O)N(=O)=O
SPLASH splash10-052f-9300000000-721a780e3bfadcff0a6c
Source of Spectrum AD-0-2532-0
Wiley ID 1427449