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7-(4-Chlorobenzoyl)-5-oxopyrrolo[2,1-b]thiazole-6-acetic acid
SpectraBase Compound ID Bok4GXORKaD
InChI InChI=1S/C15H12ClNO4S/c16-9-3-1-8(2-4-9)13(20)12-10(7-11(18)19)14(21)17-5-6-22-15(12)17/h1-4,10H,5-7H2,(H,18,19)
InChIKey MJMUYNLWZQVCIV-UHFFFAOYSA-N
Mol Weight 337.78 g/mol
Molecular Formula C15H12ClNO4S
Exact Mass 337.017557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWFVgrvFmQ3
Name 7-(4-Chlorobenzoyl)-5-oxopyrrolo[2,1-b]thiazole-6-acetic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClNO4S
InChI InChI=1S/C15H12ClNO4S/c16-9-3-1-8(2-4-9)13(20)12-10(7-11(18)19)14(21)17-5-6-22-15(12)17/h1-4,10H,5-7H2,(H,18,19)
InChIKey MJMUYNLWZQVCIV-UHFFFAOYSA-N
Molecular Weight 337.777 g/mol
SMILES OC(CC1C(=O)N2C(=C1C(c1ccc(cc1)Cl)=O)SCC2)=O
SPLASH splash10-0006-0092000000-2fc59b1025f2921141d5
Source of Spectrum SO-0-286-6
Synonyms 7-(4-Chlorobenzyl)-5-oxopyrrolo[2,1-b]thiazole-6-acetic acid [7-(4-chlorobenzoyl)-5-oxo-2,3,5,6-tetrahydropyrrolo[2,1-b][1,3]thiazol-6-yl]acetic acid
Wiley ID 1539856