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2,5-Diphenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 4h4L8gNNtD0
InChI InChI=1S/C17H11N3OS/c21-15-11-14(12-7-3-1-4-8-12)20-17(18-15)22-16(19-20)13-9-5-2-6-10-13/h1-11H
InChIKey JIRTYGQXWBLUGK-UHFFFAOYSA-N
Mol Weight 305.36 g/mol
Molecular Formula C17H11N3OS
Exact Mass 305.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xMkJcx2M9k
Name 2,5-Diphenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Alternate Name(s) 2,7-Diphenyl-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
CAS Registry Number 82090-63-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11N3OS
InChI InChI=1S/C17H11N3OS/c21-15-11-14(12-7-3-1-4-8-12)20-17(18-15)22-16(19-20)13-9-5-2-6-10-13/h1-11H
InChIKey JIRTYGQXWBLUGK-UHFFFAOYSA-N
Molecular Weight 305.355 g/mol
SMILES c1ccc(cc1)C1=CC(N=C2N1N=C(c1ccccc1)S2)=O
SPLASH splash10-0zfr-0879000000-5314f5c2b44e771d390f
Source of Spectrum O-19-434-6
Wiley ID 1307302