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(15R)-11.alpha.-Acetoxy-15,16-epoxy-ros-5-ene
SpectraBase Compound ID FUREQ2I0U9g
InChI InChI=1S/C22H34O3/c1-14(23)25-18-12-21(4,19-13-24-19)11-15-8-9-16-17(22(15,18)5)7-6-10-20(16,2)3/h9,15,17-19H,6-8,10-13H2,1-5H3/t15-,17-,18+,19-,21+,22-/m0/s1
InChIKey XAOBNTHNXLLKDN-SGUUAIRVSA-N
Mol Weight 346.5 g/mol
Molecular Formula C22H34O3
Exact Mass 346.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1JqcF1xa3b
Name (15R)-11.alpha.-Acetoxy-15,16-epoxy-ros-5-ene
Alternate Name(s) (15R)-11.beta.-Acetoxy-15,16-epoxy-ros-5-ene (2R,4R,4aS,4bS,10aS)-2,4a,8,8-tetramethyl-2-[(2R)-oxiranyl]-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-4-phenanthrenyl acetate
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Formula C22H34O3
InChI InChI=1S/C22H34O3/c1-14(23)25-18-12-21(4,19-13-24-19)11-15-8-9-16-17(22(15,18)5)7-6-10-20(16,2)3/h9,15,17-19H,6-8,10-13H2,1-5H3/t15-,17-,18+,19-,21+,22-/m0/s1
InChIKey XAOBNTHNXLLKDN-SGUUAIRVSA-N
Molecular Weight 346.511 g/mol
SMILES [C@]12([C@@]3(C(C(C)(C)CCC3)=CC[C@]1(C[C@]([C@]1(OC1)[H])(C)C[C@]2(OC(=O)C)[H])[H])[H])C
SPLASH splash10-052o-9640000000-17edaaed14095f694717
Source of Spectrum Y4-78-217-4
Wiley ID 1513032