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Dimethyl (3R,6R)-3,6-Diacetamido-9,10-bis(ethoxycarbonyl)-1,2,3,4,5,6,7,8-octahydrophenanthrene-3,6-dicarboxylate
SpectraBase Compound ID IsKs9SiNRxU
InChI InChI=1S/C28H36N2O10/c1-7-39-23(33)21-17-9-11-27(25(35)37-5,29-15(3)31)13-19(17)20-14-28(26(36)38-6,30-16(4)32)12-10-18(20)22(21)24(34)40-8-2/h7-14H2,1-6H3,(H,29,31)(H,30,32)/t27-,28-/m1/s1
InChIKey VBZRZIXIDDXJJT-VSGBNLITSA-N
Mol Weight 560.6 g/mol
Molecular Formula C28H36N2O10
Exact Mass 560.236995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDkhnAbE9XR
Name Dimethyl (3R,6R)-3,6-Diacetamido-9,10-bis(ethoxycarbonyl)-1,2,3,4,5,6,7,8-octahydrophenanthrene-3,6-dicarboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36N2O10
InChI InChI=1S/C28H36N2O10/c1-7-39-23(33)21-17-9-11-27(25(35)37-5,29-15(3)31)13-19(17)20-14-28(26(36)38-6,30-16(4)32)12-10-18(20)22(21)24(34)40-8-2/h7-14H2,1-6H3,(H,29,31)(H,30,32)/t27-,28-/m1/s1
InChIKey VBZRZIXIDDXJJT-VSGBNLITSA-N
Molecular Weight 560.600 g/mol
SMILES N([C@@]1(CCc2c(c3C[C@](CCc3c(c2C(=O)OCC)C(=O)OCC)(C(=O)OC)NC(=O)C)C1)C(=O)OC)C(=O)C
SPLASH splash10-00os-0719000000-2ccb31e6235677ce80b9
Source of Spectrum K-2001-2702-20
Wiley ID 1579887