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(8R,9S,13S,14R)-3-methoxy-13,14-dimethyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-one
SpectraBase Compound ID 1t2G6PWV0CW
InChI InChI=1S/C20H24O2/c1-19-11-9-18(21)20(19,2)10-8-16-15-6-5-14(22-3)12-13(15)4-7-17(16)19/h5-6,9,11-12,16-17H,4,7-8,10H2,1-3H3/t16-,17-,19-,20-/m1/s1
InChIKey GFIOSLJKSPQNHB-HNBVOPMISA-N
Mol Weight 296.41 g/mol
Molecular Formula C20H24O2
Exact Mass 296.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIUJPqAmTU2
Name (8R,9S,13S,14R)-3-methoxy-13,14-dimethyl-6,7,8,9,11,12-hexahydrocyclopenta[a]phenanthren-17-one
CAS Registry Number 109327-71-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O2
InChI InChI=1S/C20H24O2/c1-19-11-9-18(21)20(19,2)10-8-16-15-6-5-14(22-3)12-13(15)4-7-17(16)19/h5-6,9,11-12,16-17H,4,7-8,10H2,1-3H3/t16-,17-,19-,20-/m1/s1
InChIKey GFIOSLJKSPQNHB-HNBVOPMISA-N
Molecular Weight 296.410 g/mol
SMILES [C@@]12([C@@](C(=O)C=C2)(CC[C@]2([C@]1(CCc1cc(OC)ccc21)[H])[H])C)C
SPLASH splash10-000i-0910000000-3013750b7b47afb4c16b
Source of Spectrum KC-1987-42-22
Wiley ID 1299656