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cis-4-(2-Oxoazepan-1-yl)-2-[3,4-(methylenedioxy)phenyl]-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID 2Veom0zPply
InChI InChI=1S/C22H24N2O3/c25-22-8-2-1-5-11-24(22)19-13-18(23-17-7-4-3-6-16(17)19)15-9-10-20-21(12-15)27-14-26-20/h3-4,6-7,9-10,12,18-19,23H,1-2,5,8,11,13-14H2/t18-,19-/m0/s1
InChIKey VATYGVNRPNEQKB-OALUTQOASA-N
Mol Weight 364.45 g/mol
Molecular Formula C22H24N2O3
Exact Mass 364.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGgWxap1KXg
Name cis-4-(2-Oxoazepan-1-yl)-2-[3,4-(methylenedioxy)phenyl]-1,2,3,4-tetrahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O3
InChI InChI=1S/C22H24N2O3/c25-22-8-2-1-5-11-24(22)19-13-18(23-17-7-4-3-6-16(17)19)15-9-10-20-21(12-15)27-14-26-20/h3-4,6-7,9-10,12,18-19,23H,1-2,5,8,11,13-14H2/t18-,19-/m0/s1
InChIKey VATYGVNRPNEQKB-OALUTQOASA-N
Molecular Weight 364.445 g/mol
SMILES N1c2c([C@](C[C@]1(c1cc3OCOc3cc1)[H])(N1C(=O)CCCCC1)[H])cccc2
SPLASH splash10-0udi-1390000000-369836dd314576a05232
Source of Spectrum F4-0-2835-3
Synonyms 1-[(2S,4S)-2-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydro-4-quinolinyl]hexahydro-2H-azepin-2-one
Wiley ID 1620441