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(1 'S,2'R,3'S,4'R,4a'S,8'S,8a'R)-3-{2'-methyl-3 ',4'- Dibenzoyloxy-8'-[( S)-2-methylbutanoyloxy]decahydronapthalen-1'-yl )propyl pivalate

View entire compound with spectra: 1 MS (GC)

(1 'S,2'R,3'S,4'R,4a'S,8'S,8a'R)-3-{2'-methyl-3 ',4'- Dibenzoyloxy-8'-[( S)-2-methylbutanoyloxy]decahydronapthalen-1'-yl )propyl pivalate
SpectraBase Compound ID GQH6cJVnS7f
InChI InChI=1S/C38H50O8/c1-7-24(2)34(39)44-30-22-14-20-29-31(30)28(21-15-23-43-37(42)38(4,5)6)25(3)32(45-35(40)26-16-10-8-11-17-26)33(29)46-36(41)27-18-12-9-13-19-27/h8-13,16-19,24-25,28-33H,7,14-15,20-23H2,1-6H3/t24-,25+,28-,29-,30-,31+,32-,33+/m0/s1
InChIKey VSXPKOVVGHXBKY-LFNWXKMDSA-N
Mol Weight 634.8 g/mol
Molecular Formula C38H50O8
Exact Mass 634.350569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KHNiC3mvTb
Name (1 'S,2'R,3'S,4'R,4a'S,8'S,8a'R)-3-{2'-methyl-3 ',4'- Dibenzoyloxy-8'-[( S)-2-methylbutanoyloxy]decahydronapthalen-1'-yl )propyl pivalate
Alternate Name(s) benzoic acid [(1R,2S,3R,4S,4aR,5S,8aS)-1-benzoyloxy-4-[3-(2,2-dimethyl-1-oxopropoxy)propyl]-3-methyl-5-[(2S)-2-methyl-1-oxobutoxy]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl] ester [(1R,2S,3R,4S,4aR,5S,8aS)-1-benzoyloxy-4-[3-(2,2-dimethylpropanoyloxy)propyl]-3-methyl-5-[(2S)-2-methylbutanoyl]oxy-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl] benzoate [(1R,2S,3R,4S,4aR,5S,8aS)-1-benzoyloxy-4-[3-(2,2-dimethylpropanoyloxy)propyl]-3-methyl-5-[(2S)-2-methylbutanoyl]oxy-decalin-2-yl] benzoate [(1R,2S,3R,4S,4aR,5S,8aS)-4-[3-(2,2-dimethylpropanoyloxy)propyl]-3-methyl-5-[(2S)-2-methylbutanoyl]oxy-1-(phenylcarbonyloxy)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl] benzoate
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Formula C38H50O8
InChI InChI=1S/C38H50O8/c1-7-24(2)34(39)44-30-22-14-20-29-31(30)28(21-15-23-43-37(42)38(4,5)6)25(3)32(45-35(40)26-16-10-8-11-17-26)33(29)46-36(41)27-18-12-9-13-19-27/h8-13,16-19,24-25,28-33H,7,14-15,20-23H2,1-6H3/t24-,25+,28-,29-,30-,31+,32-,33+/m0/s1
InChIKey VSXPKOVVGHXBKY-LFNWXKMDSA-N
Molecular Weight 634.810 g/mol
SMILES [C@]1([C@@](OC(=O)c2ccccc2)([C@](C)([C@@]([C@@]2([C@@]1(CCC[C@@]2(OC(=O)[C@](CC)(C)[H])[H])[H])[H])(CCCOC(C(C)(C)C)=O)[H])[H])[H])(OC(=O)c1ccccc1)[H]
SPLASH splash10-03dr-1750910000-f6b12bd1cb7103c48942
Source of Spectrum KC-0-2429-54
Wiley ID 781865