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Cyclohexanecarboxylic acid, 1-methyl-, 1-adamantylmethyl ester
SpectraBase Compound ID 5kqOMjGLnyS
InChI InChI=1S/C19H30O2/c1-19(5-3-2-4-6-19)18(20)21-12-17-15-8-13-7-14(10-15)11-16(17)9-13/h13-17H,2-12H2,1H3/t13-,14+,15-,16+,17?
InChIKey PHVXHDUXTPERBM-SJJOOFSGSA-N
Mol Weight 290.45 g/mol
Molecular Formula C19H30O2
Exact Mass 290.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3tlTCOX5Hv
Name Cyclohexanecarboxylic acid, 1-methyl-, 1-adamantylmethyl ester
Alternate Name(s) 1-Methyl-1-cyclohexanecarboxylic acid 2-adamantylmethyl ester 1-Methylcyclohexanecarboxylic acid 2-adamantylmethyl ester 2-Adamantylmethyl 1-methylcyclohexane-1-carboxylate 2-Adamantylmethyl 1-methylcyclohexanecarboxylate
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Formula C19H30O2
InChI InChI=1S/C19H30O2/c1-19(5-3-2-4-6-19)18(20)21-12-17-15-8-13-7-14(10-15)11-16(17)9-13/h13-17H,2-12H2,1H3/t13-,14+,15-,16+,17?
InChIKey PHVXHDUXTPERBM-SJJOOFSGSA-N
Molecular Weight 290.447 g/mol
SMILES C1C(CCCC1)(C)C(OCC1[C@]2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])[H])=O
SPLASH splash10-0002-9500000000-215551da3b21ade34a5c
Source of Spectrum AD-0-2532-0
Wiley ID 1425399