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3-Phenyl-5,6,7,8-tetrahydro-isoxazolo[5,4-e](1,4)-diazepin-4-one
SpectraBase Compound ID KqmoLmQFTHA
InChI InChI=1S/C12H11N3O2/c16-11-9-10(8-4-2-1-3-5-8)15-17-12(9)14-7-6-13-11/h1-5,14H,6-7H2,(H,13,16)
InChIKey BELVAWXGWVMKSM-UHFFFAOYSA-N
Mol Weight 229.24 g/mol
Molecular Formula C12H11N3O2
Exact Mass 229.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CStLCNmnjRg
Name 3-Phenyl-5,6,7,8-tetrahydro-isoxazolo[5,4-e](1,4)-diazepin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O2
InChI InChI=1S/C12H11N3O2/c16-11-9-10(8-4-2-1-3-5-8)15-17-12(9)14-7-6-13-11/h1-5,14H,6-7H2,(H,13,16)
InChIKey BELVAWXGWVMKSM-UHFFFAOYSA-N
Molecular Weight 229.239 g/mol
SMILES N1CCNC(c2c(noc12)-c1ccccc1)=O
SPLASH splash10-004i-3960000000-6d35b5781ca1eb8575cf
Source of Spectrum D8-324-147-18
Synonyms 3-Phenyl-5,6,7,8-tetrahydro-4H-isoxazolo[5,4-e][1,4]diazepin-4-one
Wiley ID 1514024