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5-isobutyryl-6-(4-methoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

View entire compound with spectra: 1 MS (GC)

5-isobutyryl-6-(4-methoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
SpectraBase Compound ID KOdN8tzmAH8
InChI InChI=1S/C24H26N2O3/c1-15(2)24(28)26-20-9-5-4-7-18(20)25-19-8-6-10-21(27)22(19)23(26)16-11-13-17(29-3)14-12-16/h4-5,7,9,11-15,23,25H,6,8,10H2,1-3H3
InChIKey XVQDACKHJPXAJQ-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C24H26N2O3
Exact Mass 390.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KHdcBXmCdjO
Name 5-isobutyryl-6-(4-methoxyphenyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H26N2O3
InChI InChI=1S/C24H26N2O3/c1-15(2)24(28)26-20-9-5-4-7-18(20)25-19-8-6-10-21(27)22(19)23(26)16-11-13-17(29-3)14-12-16/h4-5,7,9,11-15,23,25H,6,8,10H2,1-3H3
InChIKey XVQDACKHJPXAJQ-UHFFFAOYSA-N
Molecular Weight 390.483 g/mol
SMILES N1c2c(N(C(C3=C1CCCC3=O)c1ccc(cc1)OC)C(=O)C(C)C)cccc2
SPLASH splash10-0006-9554000000-4a983b70ec188b917621
Synonyms 6-(4-Methoxyphenyl)-5-(2-methyl-1-oxopropyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one 6-(4-Methoxyphenyl)-5-(2-methylpropanoyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
Wiley ID 1453089