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15-Benzylidene-17.alpha.-methyl-18-nor-5.alpha.,13.alpha.-androstan-16-one
SpectraBase Compound ID 6YG1wBOklsG
InChI InChI=1S/C26H34O/c1-17-20-13-14-23-21(12-11-19-10-6-7-15-26(19,23)2)24(20)22(25(17)27)16-18-8-4-3-5-9-18/h3-5,8-9,16-17,19-21,23-24H,6-7,10-15H2,1-2H3/t17-,19+,20-,21+,23-,24+,26-/m0/s1
InChIKey QKWZUVDSKIIOLJ-TWXJYGMZSA-N
Mol Weight 362.6 g/mol
Molecular Formula C26H34O
Exact Mass 362.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6Rs9ftUcJh
Name 15-Benzylidene-17.alpha.-methyl-18-nor-5.alpha.,13.alpha.-androstan-16-one
Appearance White crystals
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Exact Mass 362.260965714 u
Formula C26H34O
GC Column SBA-15 (30 m)
InChI InChI=1S/C26H34O/c1-17-20-13-14-23-21(12-11-19-10-6-7-15-26(19,23)2)24(20)22(25(17)27)16-18-8-4-3-5-9-18/h3-5,8-9,16-17,19-21,23-24H,6-7,10-15H2,1-2H3/t17-,19+,20-,21+,23-,24+,26-/m0/s1
InChIKey QKWZUVDSKIIOLJ-TWXJYGMZSA-N
Instrument Name Shimadzu GCMS-QP2010 SE
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202300560
Molecular Weight 362.557 g/mol
Quality 723
Reported Formula C26H34O
SMILES C1C[C@]2([C@](CC1)(CC[C@@]1([C@@]2(CC[C@@]2([C@]1(C(C([C@]2(C)[H])=O)=CC1=CC=CC=C1)[H])[H])[H])[H])[H])C
SPLASH splash10-0006-9801000000-adfe6c6d370768db0e99
Source of Spectrum K1-26-SM11-3a (DOI: 10.1002/ejoc.202300560)
Thin-Layer Chromatography 0.59 (silica, toluene/EtOAc, 25:1)
Wiley ID 1911435