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1H-Indolizino[8,7-b]indole-1-acetic acid, 1-ethyl-2,3,5,6,11,11b-hexahydro-3-oxo-, methyl ester, cis-(.+-.)-
SpectraBase Compound ID 60NM7on66Dq
InChI InChI=1S/C19H22N2O3/c1-3-19(11-16(23)24-2)10-15(22)21-9-8-13-12-6-4-5-7-14(12)20-17(13)18(19)21/h4-7,18,20H,3,8-11H2,1-2H3/t18-,19-/m1/s1
InChIKey AAIDZLMWFBJQFW-RTBURBONSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SqJfEFbh18
Name 1H-Indolizino[8,7-b]indole-1-acetic acid, 1-ethyl-2,3,5,6,11,11b-hexahydro-3-oxo-, methyl ester, cis-(.+-.)-
CAS Registry Number 78873-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-3-19(11-16(23)24-2)10-15(22)21-9-8-13-12-6-4-5-7-14(12)20-17(13)18(19)21/h4-7,18,20H,3,8-11H2,1-2H3/t18-,19-/m1/s1
InChIKey AAIDZLMWFBJQFW-RTBURBONSA-N
Molecular Weight 326.396 g/mol
SMILES [nH]1c2ccccc2c2c1[C@]1(N(CC2)C(C[C@@]1(CC(=O)OC)CC)=O)[H]
SPLASH splash10-004i-0598000000-354852f3670b29e82682
Source of Spectrum K-114-1925-0
Synonyms Methylester of 1.beta.-Ethyl-2,3,5,6,11,11b.beta.-hexahydro-3-oxo-1H-indolizino[8,7-b]indol-1.alpha.-acetic acid Methylester 1.beta.-Ethyl-2,3,5,6,11,11b.alpha.-hexahydro-3-oxo-1H-indolizino[8,7-b]indol-1.alpha.-acetic acid Methyl[(1R,11bS)-1-ethyl-3-oxo-2,3,5,6,11,11b-hexahydro-1H-indolizino[8,7-b]indol-1-yl]acetate
Wiley ID 1324882