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Methyl [ 1R-(1.alpha.,4a.alpha.,5.beta.,6.alpha.,8a.alpha.)]-decahydro-6-hydroxymethyl-1,4a-dimethyl-5-( 4'-methyl-3'-oxopentyl)naphthalene-1-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl [ 1R-(1.alpha.,4a.alpha.,5.beta.,6.alpha.,8a.alpha.)]-decahydro-6-hydroxymethyl-1,4a-dimethyl-5-( 4'-methyl-3'-oxopentyl)naphthalene-1-carboxylate
SpectraBase Compound ID 8RGNk3oFV0n
InChI InChI=1S/C21H36O4/c1-14(2)17(23)9-8-16-15(13-22)7-10-18-20(16,3)11-6-12-21(18,4)19(24)25-5/h14-16,18,22H,6-13H2,1-5H3/t15-,16-,18+,20-,21+/m0/s1
InChIKey NEDLPMPESJHNHJ-ULZZIOJFSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oBE0K1j6fD
Name Methyl [ 1R-(1.alpha.,4a.alpha.,5.beta.,6.alpha.,8a.alpha.)]-decahydro-6-hydroxymethyl-1,4a-dimethyl-5-( 4'-methyl-3'-oxopentyl)naphthalene-1-carboxylate
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Formula C21H36O4
InChI InChI=1S/C21H36O4/c1-14(2)17(23)9-8-16-15(13-22)7-10-18-20(16,3)11-6-12-21(18,4)19(24)25-5/h14-16,18,22H,6-13H2,1-5H3/t15-,16-,18+,20-,21+/m0/s1
InChIKey NEDLPMPESJHNHJ-ULZZIOJFSA-N
Molecular Weight 352.515 g/mol
SMILES OC[C@]1([C@@]([C@]2([C@]([C@@](C(=O)OC)(C)CCC2)(CC1)[H])C)(CCC(=O)C(C)C)[H])[H]
SPLASH splash10-0abl-7193000000-946b8c5df0c182f3ec2d
Source of Spectrum AH-126-1118-16
Synonyms Methyl (1R,4aS,5S,6R,8aR)-6-(hydroxymethyl)-1,4a-dimethyl-5-(4-methyl-3-oxopentyl)decahydro-1-naphthalenecarboxylate
Wiley ID 1343525