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2,3-bis(2'-Hydroxyphenyl)-1,4-dibenzoyl-(perhydro)-benzo(!,4)-pyrazine
SpectraBase Compound ID H0gTIEsXZel
InChI InChI=1S/C34H32N2O4/c37-26-17-11-16-25(22-26)31-32(27-18-7-10-21-30(27)38)36(34(40)24-14-5-2-6-15-24)29-20-9-8-19-28(29)35(31)33(39)23-12-3-1-4-13-23/h1-7,10-18,21-22,28-29,31-32,37-38H,8-9,19-20H2/t28-,29-,31+,32+/m0/s1
InChIKey KXPHWHNRHYIJRC-ARJWVLHZSA-N
Mol Weight 532.6 g/mol
Molecular Formula C34H32N2O4
Exact Mass 532.236208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADezYVlmZab
Name 2,3-bis(2'-Hydroxyphenyl)-1,4-dibenzoyl-(perhydro)-benzo(!,4)-pyrazine
Alternate Name(s) [(2R,3R,4aS,8aS)-4-Benzoyl-3-(3-hydroxy-phenyl)-2-(2-hydroxy-phenyl)-octahydro-quinoxalin-1-yl]-phenyl-methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32N2O4
InChI InChI=1S/C34H32N2O4/c37-26-17-11-16-25(22-26)31-32(27-18-7-10-21-30(27)38)36(34(40)24-14-5-2-6-15-24)29-20-9-8-19-28(29)35(31)33(39)23-12-3-1-4-13-23/h1-7,10-18,21-22,28-29,31-32,37-38H,8-9,19-20H2/t28-,29-,31+,32+/m0/s1
InChIKey KXPHWHNRHYIJRC-ARJWVLHZSA-N
Molecular Weight 532.640 g/mol
SMILES Oc1cc([C@]2(N([C@@]3([C@@](N([C@@]2(c2c(cccc2)O)[H])C(=O)c2ccccc2)(CCCC3)[H])[H])C(=O)c2ccccc2)[H])ccc1
SPLASH splash10-0a4i-0900100000-08fd75ec96f25e8c8120
Source of Spectrum QE-14-7854-14a
Wiley ID 1692346