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(5aS,10aS,12aS)-10a,12a-dimethyl-2,3,3a,3b,4,5,5a,6,10,10a,10b,11,12,12a-tetradecahydro-1H-cyclopenta[7,8]phenanthro[2,3-c]isoxazol-1-one
SpectraBase Compound ID 8nZXLroxC6b
InChI InChI=1S/C20H27NO2/c1-19-8-7-16-14(15(19)5-6-18(19)22)4-3-13-9-17-12(11-23-21-17)10-20(13,16)2/h11,13-16H,3-10H2,1-2H3/t13-,14?,15?,16?,19-,20-/m0/s1
InChIKey GFNWFVVJCYSRFB-WWZBDCTISA-N
Mol Weight 313.44 g/mol
Molecular Formula C20H27NO2
Exact Mass 313.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5FLa5pFpMTm
Name (5aS,10aS,12aS)-10a,12a-dimethyl-2,3,3a,3b,4,5,5a,6,10,10a,10b,11,12,12a-tetradecahydro-1H-cyclopenta[7,8]phenanthro[2,3-c]isoxazol-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-19-8-7-16-14(15(19)5-6-18(19)22)4-3-13-9-17-12(11-23-21-17)10-20(13,16)2/h11,13-16H,3-10H2,1-2H3/t13-,14?,15?,16?,19-,20-/m0/s1
InChIKey GFNWFVVJCYSRFB-WWZBDCTISA-N
Literature Reference DOI 10.1016/j.jpba.2016.02.031
Molecular Weight 313.441 g/mol
SMILES c12c(C[C@]3([C@](C2)(C2C(CC3)C3[C@](CC2)(C(CC3)=O)C)C)[H])noc1
SPLASH splash10-0079-4981000000-df03cef614d6c597e95e
Source of Spectrum Christopher C. Waller, et al. Journal of Pharmaceutical and Biomedical Analysis, doi:10.1016/j.jpba.2016.02.031
Wiley ID 1816021