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2-(4-Nitrobenzyl)-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 9dcAD4EysCB
InChI InChI=1S/C10H8N2O3S/c13-9-6-16-10(11-9)5-7-1-3-8(4-2-7)12(14)15/h1-4H,5-6H2
InChIKey JYGGTWXOXAXCQI-UHFFFAOYSA-N
Mol Weight 236.24 g/mol
Molecular Formula C10H8N2O3S
Exact Mass 236.025563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2Ia4FTQ3io
Name 2-(4-Nitrobenzyl)-1,3-thiazol-4(5H)-one
CAS Registry Number 332104-05-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N2O3S
InChI InChI=1S/C10H8N2O3S/c13-9-6-16-10(11-9)5-7-1-3-8(4-2-7)12(14)15/h1-4H,5-6H2
InChIKey JYGGTWXOXAXCQI-UHFFFAOYSA-N
Molecular Weight 236.245 g/mol
SMILES C=1(SCC(N1)=O)Cc1ccc(cc1)N(=O)=O
SPLASH splash10-01p2-9300000000-0a97a3730957b58edfd4
Source of Spectrum AD-0-2532-0
Synonyms 2-(4-nitrobenzyl)-2-thiazolin-4-one 2-[(4-nitrophenyl)methyl]-1,3-thiazol-4-one 2-[(4-nitrophenyl)methyl]-4-thiazolone 2-[(4-nitrophenyl)methyl]thiazol-4-one Thiazol-4(5H)-one, 2-(4-nitrobenzyl)- Thiazol-5(4H)-one, 2-(4-nitrobenzyl)-
Wiley ID 1423453