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17-Norcorynan-18,18-dicarboxylic acid, 16-(acetyloxy)-, bis(1,1-dimethylethyl) ester, (3.beta.)-(.+-.)-
SpectraBase Compound ID KEwEq0MNGZW
InChI InChI=1S/C30H42N2O6/c1-18(33)36-17-20-15-25-26-22(21-10-8-9-11-24(21)31-26)12-13-32(25)16-19(20)14-23(27(34)37-29(2,3)4)28(35)38-30(5,6)7/h8-11,19-20,23,25,31H,12-17H2,1-7H3/t19-,20+,25+/m0/s1
InChIKey JBFBIIMJISCZPA-WZOHSFFVSA-N
Mol Weight 526.7 g/mol
Molecular Formula C30H42N2O6
Exact Mass 526.304287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zbSwyeeUh3
Name 17-Norcorynan-18,18-dicarboxylic acid, 16-(acetyloxy)-, bis(1,1-dimethylethyl) ester, (3.beta.)-(.+-.)-
Alternate Name(s) (2-.beta.-(acetoxymethyl)-1,2,3,4,6,7,12,12.beta.-octahydroindolo(2,3-a)qunolizin-3.alpha.-ylmethyl)di-t-butylmalonate di(tert-butyl) 2-({(2S,3R,12bR)-2-[(acetyloxy)methyl]-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-3-yl}methyl)malonate Indolo[2,3-a]quinolizine, 17-norcorynan-18,18-dicarboxylic acid deriv.
CAS Registry Number 88939-31-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H42N2O6
InChI InChI=1S/C30H42N2O6/c1-18(33)36-17-20-15-25-26-22(21-10-8-9-11-24(21)31-26)12-13-32(25)16-19(20)14-23(27(34)37-29(2,3)4)28(35)38-30(5,6)7/h8-11,19-20,23,25,31H,12-17H2,1-7H3/t19-,20+,25+/m0/s1
InChIKey JBFBIIMJISCZPA-WZOHSFFVSA-N
Molecular Weight 526.674 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@]1(N(CC2)C[C@@]([C@](C1)(COC(=O)C)[H])(CC(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O)[H])[H]
SPLASH splash10-00pi-0744790000-b6d27362d422068d87b8
Source of Spectrum F-39-3672-0
Wiley ID 1402842