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Ethanone, 1-(decahydro-4,6-dihydroxy-4,7-dimethyl-6-phenyl-1H-pyrrolo[2,1,5-de]quinolizin-3-yl)-, [2aS-(2a.alpha.,3.alpha.,4.alpha.,5a.alpha.,6.alpha.,7.alpha.,8a.beta.)]-
SpectraBase Compound ID GimUEZLaGN6
InChI InChI=1S/C21H29NO3/c1-13-11-16-9-10-17-19(14(2)23)20(3,24)12-18(22(16)17)21(13,25)15-7-5-4-6-8-15/h4-8,13,16-19,24-25H,9-12H2,1-3H3
InChIKey DCDDFWOASGCFGZ-UHFFFAOYSA-N
Mol Weight 343.47 g/mol
Molecular Formula C21H29NO3
Exact Mass 343.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LflB0vPMs0F
Name Ethanone, 1-(decahydro-4,6-dihydroxy-4,7-dimethyl-6-phenyl-1H-pyrrolo[2,1,5-de]quinolizin-3-yl)-, [2aS-(2a.alpha.,3.alpha.,4.alpha.,5a.alpha.,6.alpha.,7.alpha.,8a.beta.)]-
Alternate Name(s) 1-(4,6-Dihydroxy-4,7-dimethyl-6-phenyldecahydro-1H-pyrrolo[2,1,5-de]quinolizin-3-yl)ethanone Crepidin Crepidine
CAS Registry Number 34443-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO3
InChI InChI=1S/C21H29NO3/c1-13-11-16-9-10-17-19(14(2)23)20(3,24)12-18(22(16)17)21(13,25)15-7-5-4-6-8-15/h4-8,13,16-19,24-25H,9-12H2,1-3H3
InChIKey DCDDFWOASGCFGZ-UHFFFAOYSA-N
Molecular Weight 343.467 g/mol
SMILES OC1(C2CC(C)(C(C3CCC(CC1C)N23)C(C)=O)O)c1ccccc1
SPLASH splash10-052g-9753000000-b54eb09b76d3aa0c80fc
Source of Spectrum S-27-1911-1
Wiley ID 1337402