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3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
SpectraBase Compound ID 2HGWHto2hKd
InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-10-5-3-2-4-9(10)6-11(12)8-14/h6-7,11-12H,2-5H2,1H3
InChIKey YYRCIKCLWPTMMP-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5voItnIVcw
Name 3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-16-13(15)12-7-10-5-3-2-4-9(10)6-11(12)8-14/h6-7,11-12H,2-5H2,1H3
InChIKey YYRCIKCLWPTMMP-UHFFFAOYSA-N
Molecular Weight 217.268 g/mol
SMILES C1=C2C(CCCC2)=CC(C1C(=O)OC)C#N
SPLASH splash10-0693-2900000000-17e9f39cc564784383e3
Source of Spectrum U1-1998-1533-27
Synonyms Methyl 3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylate
Wiley ID 751413