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Cyclohexanecarboxylic acid, 1-tricyclo[3.3.1.1(3,7)]dec-1-yl-, methyl ester
SpectraBase Compound ID CQ4jlcJfFJo
InChI InChI=1S/C18H28O2/c1-20-16(19)18(5-3-2-4-6-18)17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,2-12H2,1H3/t13-,14+,15?,17-
InChIKey HJRMRIPZGQFQFF-BDLJLDHCSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdhjYOji2P2
Name Cyclohexanecarboxylic acid, 1-tricyclo[3.3.1.1(3,7)]dec-1-yl-, methyl ester
Alternate Name(s) Methyl 1-(1-adamantyl)cyclohexanecarboxylate Methylester of 1-(1-adamantyl)-1-cyclohexylcarboxylic acid
CAS Registry Number 69028-35-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-20-16(19)18(5-3-2-4-6-18)17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,2-12H2,1H3/t13-,14+,15?,17-
InChIKey HJRMRIPZGQFQFF-BDLJLDHCSA-N
Molecular Weight 276.420 g/mol
SMILES [C@]12(C3(C(=O)OC)CCCCC3)CC3C[C@](C1)(C[C@](C2)(C3)[H])[H]
SPLASH splash10-000i-1900000000-956bbd40ee83f71c39ae
Source of Spectrum K-116-3719-0
Wiley ID 1280478