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6.beta.-Methoxy-13-methylene-3.alpha.,5-cyclo-18-nor-13,17-seco-5.alpha.-pregnan-20-one
SpectraBase Compound ID 6L7aqF2B4gd
InChI InChI=1S/C22H34O2/c1-14-8-9-19-18(17(14)7-5-6-15(2)23)12-20(24-4)22-13-16(22)10-11-21(19,22)3/h16-20H,1,5-13H2,2-4H3/t16-,17-,18+,19+,20-,21-,22?/m1/s1
InChIKey DSKXDHBUCDLFPE-XDNQLUBISA-N
Mol Weight 330.5 g/mol
Molecular Formula C22H34O2
Exact Mass 330.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2r2mCgM9xY
Name 6.beta.-Methoxy-13-methylene-3.alpha.,5-cyclo-18-nor-13,17-seco-5.alpha.-pregnan-20-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O2
InChI InChI=1S/C22H34O2/c1-14-8-9-19-18(17(14)7-5-6-15(2)23)12-20(24-4)22-13-16(22)10-11-21(19,22)3/h16-20H,1,5-13H2,2-4H3/t16-,17-,18+,19+,20-,21-,22?/m1/s1
InChIKey DSKXDHBUCDLFPE-XDNQLUBISA-N
Molecular Weight 330.512 g/mol
SMILES C123[C@@]([C@]4(CCC([C@]([C@@]4(C[C@]3(OC)[H])[H])(CCCC(=O)C)[H])=C)[H])(CC[C@@]2(C1)[H])C
SPLASH splash10-0006-9061000000-b923bf2ae021b8ca166b
Source of Spectrum KC-1992-1846-3
Synonyms 5-[(1aS,2R,3aS,4S,7aS,7bR,9aR)-2-methoxy-7b-methyl-5-methylenedodecahydro-1H-cyclopropa[2,3]cyclopenta[1,2-a]naphthalen-4-yl]-2-pentanone 6.beta.-Methoxy-13-methylene-3.alpha.,5-cyclo-18-nor-13,17-seco-5.alpha.-pergnan-20-one
Wiley ID 776585