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N-Benzyl-(2S,3S,4S,4aS,8aR)-3,4-O-isopropylidene-2-[(1'S)-2'-dimethoxyethyl]-4a,8a-decahydroquinoline
SpectraBase Compound ID DAsNhGzsxva
InChI InChI=1S/C23H35NO4/c1-23(2)27-21-17-12-8-9-13-18(17)24(14-16-10-6-5-7-11-16)20(22(21)28-23)19(26-4)15-25-3/h5-7,10-11,17-22H,8-9,12-15H2,1-4H3/t17-,18+,19?,20-,21-,22-/m0/s1
InChIKey PZRUBWIONFTTDX-LKEQIHAESA-N
Mol Weight 389.5 g/mol
Molecular Formula C23H35NO4
Exact Mass 389.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88EmTpfM3FH
Name N-Benzyl-(2S,3S,4S,4aS,8aR)-3,4-O-isopropylidene-2-[(1'S)-2'-dimethoxyethyl]-4a,8a-decahydroquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35NO4
InChI InChI=1S/C23H35NO4/c1-23(2)27-21-17-12-8-9-13-18(17)24(14-16-10-6-5-7-11-16)20(22(21)28-23)19(26-4)15-25-3/h5-7,10-11,17-22H,8-9,12-15H2,1-4H3/t17-,18+,19?,20-,21-,22-/m0/s1
InChIKey PZRUBWIONFTTDX-LKEQIHAESA-N
Molecular Weight 389.536 g/mol
SMILES [C@@]1(N([C@]2([C@@]([C@@]3(OC(O[C@@]13[H])(C)C)[H])(CCCC2)[H])[H])Cc1ccccc1)(C(OC)COC)[H]
SPLASH splash10-0f6x-9068000000-516b665919260af302f2
Source of Spectrum J-73-5296-59
Wiley ID 1668410