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1-Methyl-N2-phenyl-3-sulfamoylisothiourea
SpectraBase Compound ID BPS1lmOYC19
InChI InChI=1S/C9H13N3O2S2/c1-10-9(15-2)12-16(13,14)11-8-6-4-3-5-7-8/h3-7,11H,1-2H3,(H,10,12)
InChIKey DLZFJQIUQHCKSK-UHFFFAOYSA-N
Mol Weight 259.34 g/mol
Molecular Formula C9H13N3O2S2
Exact Mass 259.044919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lCvppJMVNl
Name 1-Methyl-N2-phenyl-3-sulfamoylisothiourea
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N3O2S2
InChI InChI=1S/C9H13N3O2S2/c1-10-9(15-2)12-16(13,14)11-8-6-4-3-5-7-8/h3-7,11H,1-2H3,(H,10,12)
InChIKey DLZFJQIUQHCKSK-UHFFFAOYSA-N
Molecular Weight 259.342 g/mol
SMILES N(\C(=N/S(Nc1ccccc1)(=O)=O)SC)C
SPLASH splash10-0a4i-9000000000-06f20dfc57a14eadc407
Source of Spectrum SO-0-773-3
Wiley ID 1538286