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Isoxazolo[5,4-d]pyrimidine-4,6(5H,7H)-dione, 3a,7a-dihydro-3-phenyl-, cis-
SpectraBase Compound ID 8vSf2D9EZCB
InChI InChI=1S/C11H9N3O3/c15-9-7-8(6-4-2-1-3-5-6)14-17-10(7)13-11(16)12-9/h1-5,7,10H,(H2,12,13,15,16)
InChIKey CXTILDSTKGVVMS-UHFFFAOYSA-N
Mol Weight 231.21 g/mol
Molecular Formula C11H9N3O3
Exact Mass 231.064391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CoDwaM7kEZ
Name Isoxazolo[5,4-d]pyrimidine-4,6(5H,7H)-dione, 3a,7a-dihydro-3-phenyl-, cis-
Alternate Name(s) 3-Phenyl-7,7a-dihydroisoxazolo[5,4-d]pyrimidine-4,6(3ah,5H)-dione 3-Phenyl-7,7a-dihydro-3aH-isoxazolo[5,4-d]pyrimidine-4,6-dione 3-Phenyl-7,7a-dihydro-3aH-isoxazolo[5,4-d]pyrimidine-4,6-quinone 3-Phenyl-7,7a-dihydro-3aH-[1,2]oxazolo[5,4-d]pyrimidine-4,6-dione
CAS Registry Number 35053-72-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3O3
InChI InChI=1S/C11H9N3O3/c15-9-7-8(6-4-2-1-3-5-6)14-17-10(7)13-11(16)12-9/h1-5,7,10H,(H2,12,13,15,16)
InChIKey CXTILDSTKGVVMS-UHFFFAOYSA-N
Molecular Weight 231.211 g/mol
SMILES N1C(NC(=O)C2C1ON=C2c1ccccc1)=O
SPLASH splash10-0gb9-8910000000-04f4c68ee5d3b7085b21
Source of Spectrum J-7-2985-5
Wiley ID 1232586