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3-(p-Chlorophenyl)-5,6,7,8-tetrahydro-isoxazolo[5,4-e](1,4)-diazepin-4-one
SpectraBase Compound ID 96TcCwAp5rT
InChI InChI=1S/C12H10ClN3O2/c13-8-3-1-7(2-4-8)10-9-11(17)14-5-6-15-12(9)18-16-10/h1-4,15H,5-6H2,(H,14,17)
InChIKey JXQAPJOMLBRBKZ-UHFFFAOYSA-N
Mol Weight 263.68 g/mol
Molecular Formula C12H10ClN3O2
Exact Mass 263.046154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlmRQWBczQI
Name 3-(p-Chlorophenyl)-5,6,7,8-tetrahydro-isoxazolo[5,4-e](1,4)-diazepin-4-one
Alternate Name(s) 3-(4-Chlorophenyl)-5,6,7,8-tetrahydro-4H-isoxazolo[5,4-e][1,4]diazepin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10ClN3O2
InChI InChI=1S/C12H10ClN3O2/c13-8-3-1-7(2-4-8)10-9-11(17)14-5-6-15-12(9)18-16-10/h1-4,15H,5-6H2,(H,14,17)
InChIKey JXQAPJOMLBRBKZ-UHFFFAOYSA-N
Molecular Weight 263.684 g/mol
SMILES N1CCNC(c2c(noc12)-c1ccc(cc1)Cl)=O
SPLASH splash10-01vo-9440000000-67347d6c8387bc92a2e2
Source of Spectrum D8-324-147-18
Wiley ID 1514025