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N-phenyl-3-thioureido-1-diazo-pentan-2-one
SpectraBase Compound ID 5wkT5pb2OW6
InChI InChI=1S/C12H14N4OS/c1-2-6-10(17)11(15-14)16(12(13)18)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3,(H2,13,18)
InChIKey FBSYITAZPPVOPM-UHFFFAOYSA-N
Mol Weight 262.33 g/mol
Molecular Formula C12H14N4OS
Exact Mass 262.088832 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7oBaAWsqVt1
Name N-phenyl-3-thioureido-1-diazo-pentan-2-one
Alternate Name(s) N-(1-diazo-2-oxopentyl)-N-phenylthiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N4OS
InChI InChI=1S/C12H14N4OS/c1-2-6-10(17)11(15-14)16(12(13)18)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3,(H2,13,18)
InChIKey FBSYITAZPPVOPM-UHFFFAOYSA-N
Molecular Weight 262.331 g/mol
SMILES NC(N(C(=[N+]=[N-])C(=O)CCC)c1ccccc1)=S
SPLASH splash10-0f96-9100000000-29ada0ef420af626f128
Source of Spectrum HC-19-389-0
Wiley ID 1265448