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3-Phenylisoxazolo[5,4-d]pyrimidin-4(5H)-thione
SpectraBase Compound ID HuVr0LUgGM4
InChI InChI=1S/C11H7N3OS/c16-11-8-9(7-4-2-1-3-5-7)14-15-10(8)12-6-13-11/h1-6H,(H,12,13,16)
InChIKey ITNAOUOIYLABIS-UHFFFAOYSA-N
Mol Weight 229.26 g/mol
Molecular Formula C11H7N3OS
Exact Mass 229.030983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVz7Azgtmx2
Name 3-Phenylisoxazolo[5,4-d]pyrimidin-4(5H)-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7N3OS
InChI InChI=1S/C11H7N3OS/c16-11-8-9(7-4-2-1-3-5-7)14-15-10(8)12-6-13-11/h1-6H,(H,12,13,16)
InChIKey ITNAOUOIYLABIS-UHFFFAOYSA-N
Molecular Weight 229.257 g/mol
SMILES N1C(c2c(N=C1)onc2-c1ccccc1)=S
SPLASH splash10-004i-1390000000-9fc24ff492c4a3884321
Source of Spectrum H1-37-1622-1
Synonyms 3-Phenylisoxazolo[5,4-d]pyrimidine-4(5H)-thione
Wiley ID 755934