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(S)-Ethyl 1-benzyl-5-phenyl-2,3,7,8,9,9a-hexahydro-1H-pyrrolo[1,2,3-de]quinoxaline-6-carboxylate
SpectraBase Compound ID Fjls9X9qBN8
InChI InChI=1S/C26H28N2O2/c1-2-30-26(29)23-21-14-9-15-22-25(21)28(24(23)20-12-7-4-8-13-20)17-16-27(22)18-19-10-5-3-6-11-19/h3-8,10-13,22H,2,9,14-18H2,1H3/t22-/m0/s1
InChIKey UPJFWNUIVJAJAY-QFIPXVFZSA-N
Mol Weight 400.52 g/mol
Molecular Formula C26H28N2O2
Exact Mass 400.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Axi1IKdu3Q
Name (S)-Ethyl 1-benzyl-5-phenyl-2,3,7,8,9,9a-hexahydro-1H-pyrrolo[1,2,3-de]quinoxaline-6-carboxylate
Alternate Name(s) Ethyl 1-benzyl-5-phenyl-2,3,7,8,9,9a-hexahydro-1H-pyrrolo[1,2,3-de]quinoxaline-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28N2O2
InChI InChI=1S/C26H28N2O2/c1-2-30-26(29)23-21-14-9-15-22-25(21)28(24(23)20-12-7-4-8-13-20)17-16-27(22)18-19-10-5-3-6-11-19/h3-8,10-13,22H,2,9,14-18H2,1H3/t22-/m0/s1
InChIKey UPJFWNUIVJAJAY-QFIPXVFZSA-N
Molecular Weight 400.522 g/mol
SMILES c1(c([n]2CCN([C@@]3(c2c1CCC3)[H])Cc1ccccc1)-c1ccccc1)C(=O)OCC
SPLASH splash10-006x-9165100000-c1b6f2bafde2d636b04f
Source of Spectrum F5-4-3163-14e
Wiley ID 1732926