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(4bS,6aR,6bS,7S,10aS,10bR)-2-Methoxy-6a-methyl-4b,6,6a,6b,7,9,9a,10,10a,10b,11,12-dodecahydro-5H-8-oxa-7-aza-pentaleno[2,1-a]phenanthrene
SpectraBase Compound ID 7F29Qcxvuov
InChI InChI=1S/C20H27NO2/c1-20-8-7-16-15-6-4-14(22-2)9-12(15)3-5-17(16)18(20)10-13-11-23-21-19(13)20/h4,6,9,13,16-19,21H,3,5,7-8,10-11H2,1-2H3/t13-,16-,17-,18+,19+,20-/m1/s1
InChIKey VOIDUKUVGSIDAA-POJIQHKBSA-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 5epFJiI05
Name (4bS,6aR,6bS,7S,10aS,10bR)-2-Methoxy-6a-methyl-4b,6,6a,6b,7,9,9a,10,10a,10b,11,12-dodecahydro-5H-8-oxa-7-aza-pentaleno[2,1-a]phenanthrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO2
InChI InChI=1S/C20H27NO2/c1-20-8-7-16-15-6-4-14(22-2)9-12(15)3-5-17(16)18(20)10-13-11-23-21-19(13)20/h4,6,9,13,16-19,21H,3,5,7-8,10-11H2,1-2H3/t13-,16-,17-,18+,19+,20-/m1/s1
InChIKey VOIDUKUVGSIDAA-POJIQHKBSA-N
Instrument Name Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.b10
Molecular Weight 313.441 g/mol
SMILES N1OC[C@]2(C[C@]3([C@@]4(CCc5cc(ccc5[C@]4(CC[C@]3([C@@]12[H])C)[H])OC)[H])[H])[H]
SPLASH splash10-03di-0349000000-4b8cb554f64ca1f6b22b
Source of Spectrum ARK-2010-109-5
Thin-Layer Chromatography Rf = 0.22 (tert-butyl methyl ether/n-hexane, 1:1)
Wiley ID 1869948