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Bicyclo[2.2.1]heptane-2-carboxylic acid, 3,3-dimethyl-, cyanophenylmethyl ester
SpectraBase Compound ID GwBKZWxTaWc
InChI InChI=1S/C18H21NO2/c1-18(2)14-9-8-13(10-14)16(18)17(20)21-15(11-19)12-6-4-3-5-7-12/h3-7,13-16H,8-10H2,1-2H3
InChIKey NEGQFCODKKQXHW-UHFFFAOYSA-N
Mol Weight 283.37 g/mol
Molecular Formula C18H21NO2
Exact Mass 283.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5L1ejxE9mZO
Name Bicyclo[2.2.1]heptane-2-carboxylic acid, 3,3-dimethyl-, cyanophenylmethyl ester
Alternate Name(s) .alpha.-cyanobenzyl isocamphenylanate cyano(phenyl)methyl 3,3-dimethylbicyclo[2.2.1]heptane-2-carboxylate
CAS Registry Number 131230-28-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c1-18(2)14-9-8-13(10-14)16(18)17(20)21-15(11-19)12-6-4-3-5-7-12/h3-7,13-16H,8-10H2,1-2H3
InChIKey NEGQFCODKKQXHW-UHFFFAOYSA-N
Molecular Weight 283.371 g/mol
SMILES C(C1C(C2CC1CC2)(C)C)(OC(C#N)c1ccccc1)=O
SPLASH splash10-0gc0-8900000000-adb16a6fb1180af08628
Source of Spectrum AH-121-553-12
Wiley ID 1287169