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7-(4-Methoxybenzoyl)-6-(4-phenylphenyl)-3-phenylpyrazolo[5,1-b]hiazole
SpectraBase Compound ID 7CluMOPcxXz
InChI InChI=1S/C31H22N2O2S/c1-35-26-18-16-25(17-19-26)30(34)28-29(24-14-12-22(13-15-24)21-8-4-2-5-9-21)32-33-27(20-36-31(28)33)23-10-6-3-7-11-23/h2-20H,1H3
InChIKey ROQSDLWCVKEOFM-UHFFFAOYSA-N
Mol Weight 486.59 g/mol
Molecular Formula C31H22N2O2S
Exact Mass 486.140199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43t6dHaZNCm
Name 7-(4-Methoxybenzoyl)-6-(4-phenylphenyl)-3-phenylpyrazolo[5,1-b]hiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H22N2O2S
InChI InChI=1S/C31H22N2O2S/c1-35-26-18-16-25(17-19-26)30(34)28-29(24-14-12-22(13-15-24)21-8-4-2-5-9-21)32-33-27(20-36-31(28)33)23-10-6-3-7-11-23/h2-20H,1H3
InChIKey ROQSDLWCVKEOFM-UHFFFAOYSA-N
Molecular Weight 486.589 g/mol
SMILES c12[n](nc(c2C(c2ccc(cc2)OC)=O)-c2ccc(cc2)-c2ccccc2)C(c2ccccc2)=CS1
SPLASH splash10-001i-0900000000-ae9c215ab98b97b47dd7
Source of Spectrum SO-0-733-8
Wiley ID 1540135