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2-Naphthaleneacetic acid, .alpha.,1-dihydroxy-.alpha.-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, [1S-[1.alpha.(R*),2.beta.,5.alpha.]]-
SpectraBase Compound ID 72QNjk3apbC
InChI InChI=1S/C23H30O4/c1-14(2)17-11-9-15(3)13-20(17)27-22(25)23(4,26)19-12-10-16-7-5-6-8-18(16)21(19)24/h5-8,10,12,14-15,17,20,24,26H,9,11,13H2,1-4H3/t15-,17+,20-,23+/m1/s1
InChIKey HSJSFBGULBWMHC-ZCJPYKDOSA-N
Mol Weight 370.49 g/mol
Molecular Formula C23H30O4
Exact Mass 370.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEYvvhNBy9J
Name 2-Naphthaleneacetic acid, .alpha.,1-dihydroxy-.alpha.-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, [1S-[1.alpha.(R*),2.beta.,5.alpha.]]-
CAS Registry Number 91044-38-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O4
InChI InChI=1S/C23H30O4/c1-14(2)17-11-9-15(3)13-20(17)27-22(25)23(4,26)19-12-10-16-7-5-6-8-18(16)21(19)24/h5-8,10,12,14-15,17,20,24,26H,9,11,13H2,1-4H3/t15-,17+,20-,23+/m1/s1
InChIKey HSJSFBGULBWMHC-ZCJPYKDOSA-N
Molecular Weight 370.489 g/mol
SMILES O[C@@](c1c(c2ccccc2cc1)O)(C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)C
SPLASH splash10-00kk-2910000000-81f3ca81b70865c3af99
Source of Spectrum H-67-741-0
Synonyms 2-Naphthaleneacetic acid, .alpha.,1-dihydroxy-.alpha.-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl ester, [1R-[1.alpha.(S*),2.beta.,5.alpha.]]- (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl (2S)-2-hydroxy-2-(1-hydroxy-2-naphthyl)propanoate Menthyl-(+)-2-hydroxy-2-(1-hydroxy-2-naphthyl)propionate
Wiley ID 1354565