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2-Methylphenyl 1-adamantanecarboxylate
SpectraBase Compound ID IO6p83CXA9z
InChI InChI=1S/C18H22O2/c1-12-4-2-3-5-16(12)20-17(19)18-9-13-6-14(10-18)8-15(7-13)11-18/h2-5,13-15H,6-11H2,1H3/t13-,14+,15-,18-
InChIKey IJNLLRUMXOFVAF-OVMOHIIOSA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWkaUmzpU2n
Name 2-Methylphenyl 1-adamantanecarboxylate
Alternate Name(s) 1-Adamantanecarboxylic acid, 2-methylphenyl ester 1-Adamantanecarboxylic acid (2-methylphenyl) ester o-Tolyl adamantane-1-carboxylate (2-methylphenyl) adamantane-1-carboxylate
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Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-12-4-2-3-5-16(12)20-17(19)18-9-13-6-14(10-18)8-15(7-13)11-18/h2-5,13-15H,6-11H2,1H3/t13-,14+,15-,18-
InChIKey IJNLLRUMXOFVAF-OVMOHIIOSA-N
Molecular Weight 270.372 g/mol
SMILES c1(ccccc1C)OC(=O)C12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H]
SPLASH splash10-000i-7900000000-6f5393fdd221aeea7d27
Source of Spectrum NP-8-3531-0
Wiley ID 1107235