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Ethyl Cyano[5-(3-nitrobenzoyl)-2-phenylthiazol-4-yl]acetate
SpectraBase Compound ID 25uhmIKfU3f
InChI InChI=1S/C21H15N3O5S/c1-2-29-21(26)16(12-22)17-19(30-20(23-17)13-7-4-3-5-8-13)18(25)14-9-6-10-15(11-14)24(27)28/h3-11,16H,2H2,1H3
InChIKey MQUZRACJQHOQMT-UHFFFAOYSA-N
Mol Weight 421.43 g/mol
Molecular Formula C21H15N3O5S
Exact Mass 421.073242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjAQZQ6t4T3
Name Ethyl Cyano[5-(3-nitrobenzoyl)-2-phenylthiazol-4-yl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15N3O5S
InChI InChI=1S/C21H15N3O5S/c1-2-29-21(26)16(12-22)17-19(30-20(23-17)13-7-4-3-5-8-13)18(25)14-9-6-10-15(11-14)24(27)28/h3-11,16H,2H2,1H3
InChIKey MQUZRACJQHOQMT-UHFFFAOYSA-N
Molecular Weight 421.427 g/mol
SMILES C(C(c1nc(sc1C(c1cc(ccc1)N(=O)=O)=O)-c1ccccc1)C#N)(=O)OCC
SPLASH splash10-0fmi-3609400000-c3caf9146dcee0aeb328
Source of Spectrum O1-63-2326-8
Synonyms Ethyl cyano[5-(3-nitrobenzoyl)-2-phenyl-1,3-thiazol-4-yl]acetate
Wiley ID 1592841