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2-(N-Acetylanilino)-4-(chloromethyl)-5-nitrothiazole
SpectraBase Compound ID 1LeqojceUdR
InChI InChI=1S/C12H10ClN3O3S/c1-8(17)15(9-5-3-2-4-6-9)12-14-10(7-13)11(20-12)16(18)19/h2-6H,7H2,1H3
InChIKey PQKIVRBGFKQUON-UHFFFAOYSA-N
Mol Weight 311.74 g/mol
Molecular Formula C12H10ClN3O3S
Exact Mass 311.01314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7r7mzEVQ5RN
Name 2-(N-Acetylanilino)-4-(chloromethyl)-5-nitrothiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10ClN3O3S
InChI InChI=1S/C12H10ClN3O3S/c1-8(17)15(9-5-3-2-4-6-9)12-14-10(7-13)11(20-12)16(18)19/h2-6H,7H2,1H3
InChIKey PQKIVRBGFKQUON-UHFFFAOYSA-N
Molecular Weight 311.743 g/mol
SMILES c1(sc(c(n1)CCl)N(=O)=O)N(c1ccccc1)C(=O)C
SPLASH splash10-014l-6090000000-d157968e37aae6c4e5f3
Source of Spectrum F2-115-303-0
Synonyms N-[4-(chloromethyl)-5-nitro-1,3-thiazol-2-yl]-N-phenylacetamide
Wiley ID 1549623