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cis-4-(2-Oxoazepan-1-yl)-6-nitro-2-phenyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID 9Mi5UKYMMEC
InChI InChI=1S/C21H23N3O3/c25-21-9-5-2-6-12-23(21)20-14-19(15-7-3-1-4-8-15)22-18-11-10-16(24(26)27)13-17(18)20/h1,3-4,7-8,10-11,13,19-20,22H,2,5-6,9,12,14H2/t19-,20-/m0/s1
InChIKey RBSZIKBUDVKIBK-PMACEKPBSA-N
Mol Weight 365.43 g/mol
Molecular Formula C21H23N3O3
Exact Mass 365.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 90MxIwRxOXD
Name cis-4-(2-Oxoazepan-1-yl)-6-nitro-2-phenyl-1,2,3,4-tetrahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O3
InChI InChI=1S/C21H23N3O3/c25-21-9-5-2-6-12-23(21)20-14-19(15-7-3-1-4-8-15)22-18-11-10-16(24(26)27)13-17(18)20/h1,3-4,7-8,10-11,13,19-20,22H,2,5-6,9,12,14H2/t19-,20-/m0/s1
InChIKey RBSZIKBUDVKIBK-PMACEKPBSA-N
Molecular Weight 365.433 g/mol
SMILES N1c2c([C@](C[C@]1(c1ccccc1)[H])(N1C(=O)CCCCC1)[H])cc(cc2)N(=O)=O
SPLASH splash10-0udi-1690000000-baeac78181451dc380b1
Source of Spectrum F4-0-2834-3
Synonyms 1-[(2S,4S)-6-nitro-2-phenyl-1,2,3,4-tetrahydro-4-quinolinyl]hexahydro-2H-azepin-2-one
Wiley ID 1620448