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(E)-[(5R,8R,9S,10S,13R,14S)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-ylidene]-methoxy-amine
SpectraBase Compound ID 6M7udsPnsEp
InChI InChI=1S/C20H31NO/c1-19-10-4-5-17(19)16-7-6-14-13-15(21-22-3)8-12-20(14,2)18(16)9-11-19/h4,10,14,16-18H,5-9,11-13H2,1-3H3/b21-15+/t14-,16+,17+,18+,19+,20+/m1/s1
InChIKey QMLVUJIMFWQMGF-KPYNRYBPSA-N
Mol Weight 301.47 g/mol
Molecular Formula C20H31NO
Exact Mass 301.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgpldsElHcq
Name (E)-[(5R,8R,9S,10S,13R,14S)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15-dodecahydrocyclopenta[a]phenanthren-3-ylidene]-methoxy-amine
CAS Registry Number 56196-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO
InChI InChI=1S/C20H31NO/c1-19-10-4-5-17(19)16-7-6-14-13-15(21-22-3)8-12-20(14,2)18(16)9-11-19/h4,10,14,16-18H,5-9,11-13H2,1-3H3/b21-15+/t14-,16+,17+,18+,19+,20+/m1/s1
InChIKey QMLVUJIMFWQMGF-KPYNRYBPSA-N
Molecular Weight 301.474 g/mol
SMILES [C@@]12([C@@]3([C@@]([C@@]4(CC=C[C@]4(CC3)C)[H])([H])CC[C@@]2(C\C(CC1)=N\OC)[H])[H])C
SPLASH splash10-00di-0091000000-9382ad2a4cf6ebe6086b
Source of Spectrum KO-21-161-2
Wiley ID 1304076