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5,6-dimethyl-3-phenylisoxazolo[5,4-d]pyrimidin-4(5H)-one
SpectraBase Compound ID JUOgMXQO5w2
InChI InChI=1S/C13H11N3O2/c1-8-14-12-10(13(17)16(8)2)11(15-18-12)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey JUQNNFYRZXPHIJ-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C13H11N3O2
Exact Mass 241.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MWuudgSXFO
Name 5,6-dimethyl-3-phenylisoxazolo[5,4-d]pyrimidin-4(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3O2
InChI InChI=1S/C13H11N3O2/c1-8-14-12-10(13(17)16(8)2)11(15-18-12)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey JUQNNFYRZXPHIJ-UHFFFAOYSA-N
Instrument Name VG AutoSpec 6F
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290061108
Molecular Weight 241.250 g/mol
SMILES c1(noc2c1C(N(C(=N2)C)C)=O)-c1ccccc1
SPLASH splash10-0006-5930000000-fce05ca3e60fe7d03b0f
Source of Spectrum RCM-6-667-1d
Wiley ID 1835552