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OLCJYNROJQOFKI-CVNLYIMZSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

OLCJYNROJQOFKI-CVNLYIMZSA-N
SpectraBase Compound ID JonBmCbZpu9
InChI InChI=1S/C23H34O4/c1-14(2)16-8-9-18-17(12-16)19(27-15(3)24)13-20-22(18,4)10-7-11-23(20,5)21(25)26-6/h12,14,18,20H,7-11,13H2,1-6H3/t18-,20+,22+,23+/m0/s1
InChIKey OLCJYNROJQOFKI-CVNLYIMZSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwKwAQpdSOX
Name (1R,4aR,4bR,10aR)-9-acetoxy-7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester
Alternate Name(s) (1R,4aR,4bR,10aR)-9-acetyloxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester Methyl (1R,4aR,4bR,10aR)-9-acetoxy-7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate Methyl (1R,4aR,4bR,10aR)-9-acetyloxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate
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Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-14(2)16-8-9-18-17(12-16)19(27-15(3)24)13-20-22(18,4)10-7-11-23(20,5)21(25)26-6/h12,14,18,20H,7-11,13H2,1-6H3/t18-,20+,22+,23+/m0/s1
InChIKey OLCJYNROJQOFKI-CVNLYIMZSA-N
Molecular Weight 374.521 g/mol
SMILES C12=C(C[C@@]3([C@@]([C@]2(CCC(=C1)C(C)C)[H])(CCC[C@]3(C(=O)OC)C)C)[H])OC(=O)C
SPLASH splash10-0a4j-0009000000-f7f1ae7ebce37186ca34
Source of Spectrum AH-133-237-11
Wiley ID 1546632