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2-(3-Methoxyphenyl)-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
SpectraBase Compound ID Iu1Y4MtbzOS
InChI InChI=1S/C12H9N3O2S/c1-17-9-4-2-3-8(7-9)11-14-15-10(16)5-6-13-12(15)18-11/h2-7H,1H3
InChIKey QHEYIZQEGUAJSP-UHFFFAOYSA-N
Mol Weight 259.28 g/mol
Molecular Formula C12H9N3O2S
Exact Mass 259.041548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HcDkZ6UGOSu
Name 2-(3-Methoxyphenyl)-5H-1,3,4-thiadiazolo[3,2-a]pyrimidin-5-one
Alternate Name(s) 2-(3-Methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N3O2S
InChI InChI=1S/C12H9N3O2S/c1-17-9-4-2-3-8(7-9)11-14-15-10(16)5-6-13-12(15)18-11/h2-7H,1H3
InChIKey QHEYIZQEGUAJSP-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C4RA02714K
Molecular Weight 259.283 g/mol
SMILES C12=NC=CC(N2N=C(S1)c1cc(ccc1)OC)=O
SPLASH splash10-0pb9-9660000000-8dc23ab2f021b48b90d3
Source of Spectrum RSA-4-55827/SM4-3c
Wiley ID 1805477