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2.beta.-hydroxy-9-oxoverrucosane
SpectraBase Compound ID A6ypBX9NS74
InChI InChI=1S/C20H32O2/c1-11(2)13-6-7-19(4)14(21)10-18(3)8-12-9-20(12,5)17(22)16(18)15(13)19/h11-13,15-17,22H,6-10H2,1-5H3/t12?,13-,15+,16-,17-,18+,19+,20+/m0/s1
InChIKey ILFMQXQRJLIDJX-GASCPIDDSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOmMgOdBb9k
Name 2.beta.-hydroxy-9-oxoverrucosane
Alternate Name(s) (1S,3aS,5aR,7aR,8S,8aR,8bR)-8-hydroxy-1-isopropyl-3a,5a,7a-trimethyldodecahydrocyclopenta[a]cyclopropa[g]naphthalen-4(1H)-one
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Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-11(2)13-6-7-19(4)14(21)10-18(3)8-12-9-20(12,5)17(22)16(18)15(13)19/h11-13,15-17,22H,6-10H2,1-5H3/t12?,13-,15+,16-,17-,18+,19+,20+/m0/s1
InChIKey ILFMQXQRJLIDJX-GASCPIDDSA-N
Molecular Weight 304.474 g/mol
SMILES O[C@]1([C@]2([C@](CC([C@@]3([C@@]2([C@@](CC3)(C(C)C)[H])[H])C)=O)(C)CC2[C@]1(C2)C)[H])[H]
SPLASH splash10-052f-8930000000-e2dd1f22e034192d2701
Source of Spectrum M-30-334-6
Wiley ID 1306939