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2-[4-(4-Iodophenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID LMBkHYYfxg2
InChI InChI=1S/C13H10IN3OS/c1-8-6-12(18)17(16-8)13-15-11(7-19-13)9-2-4-10(14)5-3-9/h2-5,7H,6H2,1H3
InChIKey DOWOISHPSMFFSO-UHFFFAOYSA-N
Mol Weight 383.21 g/mol
Molecular Formula C13H10IN3OS
Exact Mass 382.958928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FA2Df01Kisu
Name 2-[4-(4-Iodophenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
CAS Registry Number 331739-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10IN3OS
InChI InChI=1S/C13H10IN3OS/c1-8-6-12(18)17(16-8)13-15-11(7-19-13)9-2-4-10(14)5-3-9/h2-5,7H,6H2,1H3
InChIKey DOWOISHPSMFFSO-UHFFFAOYSA-N
Molecular Weight 383.207 g/mol
SMILES c1(N2C(CC(=N2)C)=O)nc(-c2ccc(I)cc2)cs1
SPLASH splash10-00ai-7923000000-be30a9b45731a96e4896
Synonyms 2-[4-(4-Iodo-phenyl)-thiazol-2-yl]-5-methyl-2,4-dihydro-pyrazol-3-one 2-[4-(4-iodophenyl)-1,3-thiazol-2-yl]-5-methyl-4H-pyrazol-3-one 2-[4-(4-iodophenyl)-2-thiazolyl]-5-methyl-4H-pyrazol-3-one 2-[4-(4-iodophenyl)thiazol-2-yl]-5-methyl-2-pyrazolin-3-one 2-[4-(4-iodophenyl)thiazol-2-yl]-5-methyl-4H-pyrazol-3-one
Wiley ID 1460584