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(1S,5S,6aS,6bS,12bS,14aR)-10-methoxy-14a-methyl-1,2,5,6,6a,6b,7,8,12b,13,14,14a-dodecahydro-3H-1,5-methanophenanthro[1,2-d]oxocin-3-one

View entire compound with spectra: 1 MS (GC)

(1S,5S,6aS,6bS,12bS,14aR)-10-methoxy-14a-methyl-1,2,5,6,6a,6b,7,8,12b,13,14,14a-dodecahydro-3H-1,5-methanophenanthro[1,2-d]oxocin-3-one
SpectraBase Compound ID 3Kc1SkxUAmJ
InChI InChI=1S/C22H28O3/c1-22-8-7-18-17-6-4-15(24-2)9-13(17)3-5-19(18)20(22)12-16-10-14(22)11-21(23)25-16/h4,6,9,14,16,18-20H,3,5,7-8,10-12H2,1-2H3/t14-,16-,18+,19+,20-,22+/m0/s1
InChIKey RNMIEXGUIQTNKH-CMUZMBBFSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jwls9WSo1Qt
Name (1S,5S,6aS,6bS,12bS,14aR)-10-methoxy-14a-methyl-1,2,5,6,6a,6b,7,8,12b,13,14,14a-dodecahydro-3H-1,5-methanophenanthro[1,2-d]oxocin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-22-8-7-18-17-6-4-15(24-2)9-13(17)3-5-19(18)20(22)12-16-10-14(22)11-21(23)25-16/h4,6,9,14,16,18-20H,3,5,7-8,10-12H2,1-2H3/t14-,16-,18+,19+,20-,22+/m0/s1
InChIKey RNMIEXGUIQTNKH-CMUZMBBFSA-N
Molecular Weight 340.463 g/mol
SMILES c1cc2c(cc1OC)CC[C@@]1([C@@]2(CC[C@]2([C@]1(C[C@]1(OC(C[C@@]2(C1)[H])=O)[H])[H])C)[H])[H]
SPLASH splash10-0006-0209000000-0dbd9fa1360f3d9acfbb
Source of Spectrum K-124-593-12
Wiley ID 1792175