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(E)-3-phenyl-1-[2,4,4-trimethyl-5-[(E)-1-oxo-3-phenylprop-2-enyl]-2,3-dihydro-1,5-benzodiazepin-1-yl]-2-propen-1-one
SpectraBase Compound ID 7Dc9kflRX14
InChI InChI=1S/C30H30N2O2/c1-23-22-30(2,3)32(29(34)21-19-25-14-8-5-9-15-25)27-17-11-10-16-26(27)31(23)28(33)20-18-24-12-6-4-7-13-24/h4-21,23H,22H2,1-3H3/b20-18+,21-19+
InChIKey XNYORQNYNCHNCJ-FRCMOREXSA-N
Mol Weight 450.58 g/mol
Molecular Formula C30H30N2O2
Exact Mass 450.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AStqRqWOieK
Name (E)-3-phenyl-1-[2,4,4-trimethyl-5-[(E)-1-oxo-3-phenylprop-2-enyl]-2,3-dihydro-1,5-benzodiazepin-1-yl]-2-propen-1-one
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Formula C30H30N2O2
InChI InChI=1S/C30H30N2O2/c1-23-22-30(2,3)32(29(34)21-19-25-14-8-5-9-15-25)27-17-11-10-16-26(27)31(23)28(33)20-18-24-12-6-4-7-13-24/h4-21,23H,22H2,1-3H3/b20-18+,21-19+
InChIKey XNYORQNYNCHNCJ-FRCMOREXSA-N
Molecular Weight 450.582 g/mol
SMILES c12N(C(CC(N(c2cccc1)C(\C=C\c1ccccc1)=O)C)(C)C)C(\C=C\c1ccccc1)=O
SPLASH splash10-005l-0900100000-7af690749fb2eedab90f
Source of Spectrum D9-334-7-6
Synonyms 1,5-Dicinnamoyl-2,2,4-trimethyl-1H-2,3,4,5-tetrahydro-1.5-benzodiazepine (E)-3-phenyl-1-[2,4,4-trimethyl-5-[(E)-3-phenylacryloyl]-2,3-dihydro-1,5-benzodiazepin-1-yl]prop-2-en-1-one (E)-3-phenyl-1-[2,4,4-trimethyl-5-[(E)-3-phenylprop-2-enoyl]-2,3-dihydro-1,5-benzodiazepin-1-yl]prop-2-en-1-one (2E,2'E)-1,1'-(2,2,4-trimethyl-3,4-dihydro-1H-benzo[b][1,4]diazepine-1,5(2H)-diyl)bis(3-phenylprop-2-en-1-one)
Wiley ID 1550793