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2-naphthaleneoctanoic acid, decahydro-.beta.,.epsilon.-dihydroxy-.alpha.,.epsilon.,1,1,3,6-hexamethyl-, methyl ester
SpectraBase Compound ID HftVBkjfgE0
InChI InChI=1S/C25H46O4/c1-16-8-9-21-19(14-16)15-17(2)20(24(21,4)5)10-12-25(6,28)13-11-22(26)18(3)23(27)29-7/h16-22,26,28H,8-15H2,1-7H3
InChIKey PAODXWQZAIVWKK-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H46O4
Exact Mass 410.33961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 625bghZn1yE
Name 2-naphthaleneoctanoic acid, decahydro-.beta.,.epsilon.-dihydroxy-.alpha.,.epsilon.,1,1,3,6-hexamethyl-, methyl ester
CAS Registry Number 105969-72-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H46O4
InChI InChI=1S/C25H46O4/c1-16-8-9-21-19(14-16)15-17(2)20(24(21,4)5)10-12-25(6,28)13-11-22(26)18(3)23(27)29-7/h16-22,26,28H,8-15H2,1-7H3
InChIKey PAODXWQZAIVWKK-UHFFFAOYSA-N
Molecular Weight 410.639 g/mol
SMILES OC(CCC(CCC1C(C2C(CC(CC2)C)CC1C)(C)C)(O)C)C(C(=O)OC)C
SPLASH splash10-00di-0901000000-a9e341183b50c10c0256
Source of Spectrum J-52-341-11
Synonyms Methyl 3,6-dihydroxy-2,6-dimethyl-8-(1,1,3,6-tetramethyldecahydro-2-naphthalenyl)octanoate
Wiley ID 1373780