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((2S,3S,4aR,8aR)-2,3-bis(2-hydroxyphenyl)octahydroquinoxaline-1,4-diyl)bis(phenylmethanone)
SpectraBase Compound ID GQtnSsGSD3K
InChI InChI=1S/C34H32N2O4/c37-29-21-11-7-17-25(29)31-32(26-18-8-12-22-30(26)38)36(34(40)24-15-5-2-6-16-24)28-20-10-9-19-27(28)35(31)33(39)23-13-3-1-4-14-23/h1-8,11-18,21-22,27-28,31-32,37-38H,9-10,19-20H2/t27-,28-,31+,32+/m1/s1
InChIKey HJCUAHGBBTWNRS-CKROWEISSA-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 5hoaz10J9R4
Name ((2S,3S,4aR,8aR)-2,3-bis(2-hydroxyphenyl)octahydroquinoxaline-1,4-diyl)bis(phenylmethanone)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32N2O4
InChI InChI=1S/C34H32N2O4/c37-29-21-11-7-17-25(29)31-32(26-18-8-12-22-30(26)38)36(34(40)24-15-5-2-6-16-24)28-20-10-9-19-27(28)35(31)33(39)23-13-3-1-4-14-23/h1-8,11-18,21-22,27-28,31-32,37-38H,9-10,19-20H2/t27-,28-,31+,32+/m1/s1
InChIKey HJCUAHGBBTWNRS-CKROWEISSA-N
Molecular Weight 532.640 g/mol
SMILES Oc1c([C@]2([C@](c3c(cccc3)O)(N([C@]3([C@](N2C(c2ccccc2)=O)(CCCC3)[H])[H])C(=O)c2ccccc2)[H])[H])cccc1
SPLASH splash10-0a4i-0900100000-08fd75ec96f25e8c8120
Source of Spectrum ASC-348-1049/SM3-(2S,3S,5R,6R)_8b
Wiley ID 1765251