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2-(2-Chlorophenyl)-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
SpectraBase Compound ID AFstwWvvtCY
InChI InChI=1S/C11H6ClN3OS/c12-8-4-2-1-3-7(8)10-14-15-9(16)5-6-13-11(15)17-10/h1-6H
InChIKey XVAQQIBIWAXXBI-UHFFFAOYSA-N
Mol Weight 263.7 g/mol
Molecular Formula C11H6ClN3OS
Exact Mass 262.992011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pWaFFQkCXx
Name 2-(2-Chlorophenyl)-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H6ClN3OS
InChI InChI=1S/C11H6ClN3OS/c12-8-4-2-1-3-7(8)10-14-15-9(16)5-6-13-11(15)17-10/h1-6H
InChIKey XVAQQIBIWAXXBI-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C4RA02714K
Molecular Weight 263.702 g/mol
SMILES C12=NC=CC(N2N=C(S1)c1c(cccc1)Cl)=O
SPLASH splash10-0002-9320000000-a88231dacb4d2798f3da
Source of Spectrum RSA-4-55827/SM5-3i
Synonyms 2-(2-Chlorophenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Wiley ID 1805483