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(3S,8S,9S,10R,13S,14S,17S)-17-(1-aminoethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine

View entire compound with spectra: 1 MS (GC)

(3S,8S,9S,10R,13S,14S,17S)-17-(1-aminoethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine
SpectraBase Compound ID 3Kgy2WqGkrs
InChI InChI=1S/C21H36N2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15-19H,5-12,22-23H2,1-3H3/t13?,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKey XDELLWIDOQOKHV-GGJKPFIYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H36N2
Exact Mass 316.287849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tElXfeVn4e
Name (3S,8S,9S,10R,13S,14S,17S)-17-(1-aminoethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine
CAS Registry Number 85719-25-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36N2
InChI InChI=1S/C21H36N2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,13,15-19H,5-12,22-23H2,1-3H3/t13?,15-,16-,17+,18-,19-,20-,21+/m0/s1
InChIKey XDELLWIDOQOKHV-GGJKPFIYSA-N
Molecular Weight 316.533 g/mol
SMILES N[C@]1(CC[C@]2(C(=CC[C@]3([C@]4([C@@]([C@@](C(N)C)(CC4)[H])(CC[C@]23[H])C)[H])[H])C1)C)[H]
SPLASH splash10-0006-9340000000-b4056a1692c9cb287fed
Source of Spectrum O-18-1-1
Synonyms (3S,8S,9S,10R,13S,14S,17S)-17-(1-azanylethyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine 1-[(3S,8S,9S,10R,13S,14S,17S)-3-amino-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethylamine
Wiley ID 1317323