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(4bS,5aR,9aS)-4b-p-Tolyl-6,7,8,9,9a,10-hexahydro-4bH,5aH-5-oxa-10a-aza-benzo[b]fluoren-11-one
SpectraBase Compound ID 4vcAYcyCBdE
InChI InChI=1S/C22H23NO2/c1-15-10-12-17(13-11-15)22-19-8-4-3-7-18(19)21(24)23(22)14-16-6-2-5-9-20(16)25-22/h3-4,7-8,10-13,16,20H,2,5-6,9,14H2,1H3/t16-,20+,22-/m0/s1
InChIKey PMVQTAHIYYEHGT-AQKFKSFVSA-N
Mol Weight 333.43 g/mol
Molecular Formula C22H23NO2
Exact Mass 333.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMp2PvAs6Sb
Name (4bS,5aR,9aS)-4b-p-Tolyl-6,7,8,9,9a,10-hexahydro-4bH,5aH-5-oxa-10a-aza-benzo[b]fluoren-11-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO2
InChI InChI=1S/C22H23NO2/c1-15-10-12-17(13-11-15)22-19-8-4-3-7-18(19)21(24)23(22)14-16-6-2-5-9-20(16)25-22/h3-4,7-8,10-13,16,20H,2,5-6,9,14H2,1H3/t16-,20+,22-/m0/s1
InChIKey PMVQTAHIYYEHGT-AQKFKSFVSA-N
Instrument Name Jeol JMS-D300
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19960715)10_9_1013
Molecular Weight 333.431 g/mol
SMILES [C@]12(N(C[C@]3([C@](O2)(CCCC3)[H])[H])C(c2c1cccc2)=O)c1ccc(cc1)C
SPLASH splash10-000x-2596000000-b3557c6d39ebdb59c85e
Source of Spectrum RCM-10-1018-9
Wiley ID 1836063