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(1S,4aR,4bS,8R,8aS,10aR)-8-(2-hydroxyethyl)-1,4a-dimethyl-7-methylene-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(1S,4aR,4bS,8R,8aS,10aR)-8-(2-hydroxyethyl)-1,4a-dimethyl-7-methylene-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
SpectraBase Compound ID IeLO4PUSPFu
InChI InChI=1S/C21H34O3/c1-14-6-8-17-16(15(14)10-13-22)7-9-18-20(17,2)11-5-12-21(18,3)19(23)24-4/h15-18,22H,1,5-13H2,2-4H3/t15-,16-,17-,18+,20+,21-/m0/s1
InChIKey PQFNNXOKMUDTNO-XUJUZBCESA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pZ3iqu90YQ
Name (1S,4aR,4bS,8R,8aS,10aR)-8-(2-hydroxyethyl)-1,4a-dimethyl-7-methylene-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester
Alternate Name(s) Methyl (1S,4aR,4bS,8R,8aS,10aR)-8-(2-hydroxyethyl)-1,4a-dimethyl-7-methylene-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate Methyl (1S,4aR,4bS,8R,8aS,10aR)-8-(2-hydroxyethyl)-1,4a-dimethyl-7-methylidene-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate
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Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-14-6-8-17-16(15(14)10-13-22)7-9-18-20(17,2)11-5-12-21(18,3)19(23)24-4/h15-18,22H,1,5-13H2,2-4H3/t15-,16-,17-,18+,20+,21-/m0/s1
InChIKey PQFNNXOKMUDTNO-XUJUZBCESA-N
Molecular Weight 334.500 g/mol
SMILES OCC[C@@]1([C@]2([C@@]([C@@]3([C@]([C@](C(=O)OC)(C)CCC3)(CC2)[H])C)(CCC1=C)[H])[H])[H]
SPLASH splash10-00dl-3930000000-ccb9f6bf9fe0de9310c6
Source of Spectrum F-47-3843-17
Wiley ID 1331345