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1H-Indolizino[8,7-b]indole-2-propanoic acid, .alpha.-ethyl-2,3,5,6,11,11b-hexahydro-3-thioxo-, methyl ester
SpectraBase Compound ID Fvzf9ZlNmvX
InChI InChI=1S/C20H24N2O2S/c1-3-12(20(23)24-2)10-13-11-17-18-15(8-9-22(17)19(13)25)14-6-4-5-7-16(14)21-18/h4-7,12-13,17,21H,3,8-11H2,1-2H3
InChIKey RHPXABPOCXDXKE-UHFFFAOYSA-N
Mol Weight 356.48 g/mol
Molecular Formula C20H24N2O2S
Exact Mass 356.155849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46A5kjLoQLa
Name 1H-Indolizino[8,7-b]indole-2-propanoic acid, .alpha.-ethyl-2,3,5,6,11,11b-hexahydro-3-thioxo-, methyl ester
CAS Registry Number 16499-03-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N2O2S
InChI InChI=1S/C20H24N2O2S/c1-3-12(20(23)24-2)10-13-11-17-18-15(8-9-22(17)19(13)25)14-6-4-5-7-16(14)21-18/h4-7,12-13,17,21H,3,8-11H2,1-2H3
InChIKey RHPXABPOCXDXKE-UHFFFAOYSA-N
Molecular Weight 356.484 g/mol
SMILES [nH]1c2ccccc2c2CCN3C(c12)CC(C3=S)CC(C(=O)OC)CC
SPLASH splash10-0aor-0948000000-b80e6529b2e578326dd5
Source of Spectrum F-36-1060-0
Synonyms 1H-indolizino[8,7-b]indole-2-propionic acid, .alpha.-ethyl-2,3,5,6,11,11b-hexahydro-3-thioxo-, methyl ester 2-(2'-Methoxycarbonyl butane)-3-thio-1,2,3,5,6,11b-hexahydro-11-H-indolo-I Methyl 2-[(3-thioxo-2,3,5,6,11,11b-hexahydro-1H-indolizino[8,7-b]indol-2-yl)methyl]butanoate
Wiley ID 1345829