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1,4b,5,6,10,10a-Hexahydro-4b.beta.,8,10a.beta.-trimethyl-3(2H)-phenanthrenone
SpectraBase Compound ID 8U3vSkM6Tos
InChI InChI=1S/C17H22O/c1-12-5-4-8-17(3)14(12)7-10-16(2)9-6-13(18)11-15(16)17/h5,7,11H,4,6,8-10H2,1-3H3/t16-,17+/m0/s1
InChIKey WQTSOAFURFBRLX-DLBZAZTESA-N
Mol Weight 242.36 g/mol
Molecular Formula C17H22O
Exact Mass 242.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NnLgGbm1Qj
Name 1,4b,5,6,10,10a-Hexahydro-4b.beta.,8,10a.beta.-trimethyl-3(2H)-phenanthrenone
Alternate Name(s) (4bS,10aS)-4b,8,10a-trimethyl-1,4b,5,6,10,10a-hexahydro-3(2H)-phenanthrenone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O
InChI InChI=1S/C17H22O/c1-12-5-4-8-17(3)14(12)7-10-16(2)9-6-13(18)11-15(16)17/h5,7,11H,4,6,8-10H2,1-3H3/t16-,17+/m0/s1
InChIKey WQTSOAFURFBRLX-DLBZAZTESA-N
Molecular Weight 242.362 g/mol
SMILES C1=2[C@]3(C(C(C)=CCC3)=CC[C@@]1(CCC(C2)=O)C)C
SPLASH splash10-002f-0090000000-2c176bc18b279eab622d
Source of Spectrum AJ-61-3594-12
Wiley ID 1245676