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(1S*,2R*,8S*)-1,2-cis-1,8-trans-2,8-Dimethyl-1-(4-nitrophenyl)-2-phenyl-1,2-dihydroazeto[2,1-b]quinazoline
SpectraBase Compound ID 4pnaZFCp1OX
InChI InChI=1S/C24H21N3O2/c1-16-20-10-6-7-11-21(20)25-23-24(2,18-8-4-3-5-9-18)22(26(16)23)17-12-14-19(15-13-17)27(28)29/h3-16,22H,1-2H3/t16-,22-,24+/m0/s1
InChIKey FPTHJHDUZWRVRB-UIDQEFQQSA-N
Mol Weight 383.45 g/mol
Molecular Formula C24H21N3O2
Exact Mass 383.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ldY51pQim2
Name (1S*,2R*,8S*)-1,2-cis-1,8-trans-2,8-Dimethyl-1-(4-nitrophenyl)-2-phenyl-1,2-dihydroazeto[2,1-b]quinazoline
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N3O2
InChI InChI=1S/C24H21N3O2/c1-16-20-10-6-7-11-21(20)25-23-24(2,18-8-4-3-5-9-18)22(26(16)23)17-12-14-19(15-13-17)27(28)29/h3-16,22H,1-2H3/t16-,22-,24+/m0/s1
InChIKey FPTHJHDUZWRVRB-UIDQEFQQSA-N
Molecular Weight 383.451 g/mol
SMILES C1=2N([C@@](C)(c3c(N2)cccc3)[H])[C@]([C@]1(c1ccccc1)C)(c1ccc(N(=O)=O)cc1)[H]
SPLASH splash10-0159-0009000000-47891902981039f8b826
Source of Spectrum KD-15-492-3
Wiley ID 1636835