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1, 3-Dimethyl-5-nitro-3-(phenylthio)indolin-2-one
SpectraBase Compound ID GzeoJAbMIRl
InChI InChI=1S/C16H14N2O3S/c1-16(22-12-6-4-3-5-7-12)13-10-11(18(20)21)8-9-14(13)17(2)15(16)19/h3-10H,1-2H3
InChIKey DRJSLAOAQPLZRB-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C16H14N2O3S
Exact Mass 314.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdkKwsnK1pL
Name 1, 3-Dimethyl-5-nitro-3-(phenylthio)indolin-2-one
Alternate Name(s) 1,3-Dimethyl-5-nitro-3-(phenylthio)indolin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N2O3S
InChI InChI=1S/C16H14N2O3S/c1-16(22-12-6-4-3-5-7-12)13-10-11(18(20)21)8-9-14(13)17(2)15(16)19/h3-10H,1-2H3
InChIKey DRJSLAOAQPLZRB-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200091k
Molecular Weight 314.359 g/mol
SMILES C1(C(=O)N(C)c2ccc(cc12)[N+](=O)[O-])(Sc1ccccc1)C
SPLASH splash10-0a4i-1691000000-4f9db89d9c9f260c2a8d
Source of Spectrum A1-13-1210/SMS12-3n
Wiley ID 1752886