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13bS-p-tolyl-2,2aR,3,6,6aS,7-hexahydroisoindolo[1,2-c][2,4]benzoxazepin-9-one
SpectraBase Compound ID 2ttZdANkvSj
InChI InChI=1S/C23H23NO2/c1-16-10-12-19(13-11-16)23-21-9-5-4-8-20(21)22(25)24(23)14-17-6-2-3-7-18(17)15-26-23/h2-5,8-13,17-18H,6-7,14-15H2,1H3/t17-,18+,23+/m1/s1
InChIKey BCLCYPWLFIWJAB-STSQHVNTSA-N
Mol Weight 345.44 g/mol
Molecular Formula C23H23NO2
Exact Mass 345.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 29TUdbNwMC
Name 13bS-p-tolyl-2,2aR,3,6,6aS,7-hexahydroisoindolo[1,2-c][2,4]benzoxazepin-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23NO2
InChI InChI=1S/C23H23NO2/c1-16-10-12-19(13-11-16)23-21-9-5-4-8-20(21)22(25)24(23)14-17-6-2-3-7-18(17)15-26-23/h2-5,8-13,17-18H,6-7,14-15H2,1H3/t17-,18+,23+/m1/s1
InChIKey BCLCYPWLFIWJAB-STSQHVNTSA-N
Instrument Name Jeol JMS-D300
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19960715)10_9_1013
Molecular Weight 345.442 g/mol
SMILES c1cc2c(cc1)[C@]1(N(C2=O)C[C@@]2([C@](CO1)(CC=CC2)[H])[H])c1ccc(cc1)C
SPLASH splash10-00di-1393000000-fbe48500fc5ad887a1d7
Source of Spectrum RCM-10-1015-2
Wiley ID 1836057