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1-Cyclohexylcarbamoyl-1,2-dihydroisoquinoline-2-carboxylic acid methyl ester
SpectraBase Compound ID 54qxey9L4Dg
InChI InChI=1S/C18H22N2O3/c1-23-18(22)20-12-11-13-7-5-6-10-15(13)16(20)17(21)19-14-8-3-2-4-9-14/h5-7,10-12,14,16H,2-4,8-9H2,1H3,(H,19,21)
InChIKey KEHPBBNYCHAGET-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C18H22N2O3
Exact Mass 314.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HTc2aXmR3AY
Name 1-Cyclohexylcarbamoyl-1,2-dihydroisoquinoline-2-carboxylic acid methyl ester
Alternate Name(s) Methyl 1-[(cyclohexylamino)carbonyl]-2(1H)-isoquinolinecarboxylate
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Formula C18H22N2O3
InChI InChI=1S/C18H22N2O3/c1-23-18(22)20-12-11-13-7-5-6-10-15(13)16(20)17(21)19-14-8-3-2-4-9-14/h5-7,10-12,14,16H,2-4,8-9H2,1H3,(H,19,21)
InChIKey KEHPBBNYCHAGET-UHFFFAOYSA-N
Molecular Weight 314.385 g/mol
SMILES N(C(C1N(C=Cc2ccccc12)C(=O)OC)=O)C1CCCCC1
SPLASH splash10-000i-0900000000-2231847ecda8340a077e
Source of Spectrum F-69-3552-2
Wiley ID 1595122