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6-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
SpectraBase Compound ID JLDtXZI0NT1
InChI InChI=1S/C19H22N2O3/c1-12-13(14-6-4-5-9-17(14)21-12)10-11-20-18(22)15-7-2-3-8-16(15)19(23)24/h2-6,9,15-16,21H,7-8,10-11H2,1H3,(H,20,22)(H,23,24)
InChIKey BWNVJRYTHVWIGP-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrmcRM7BggL
Name 6-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohex-3-ene-1-carboxylic acid
Alternate Name(s) 6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid Cyclohex-3-enecarboxylic acid, 6-[2-(2-methyl-1H-indol-3-yl)ethylcarbamoyl]-
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Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-12-13(14-6-4-5-9-17(14)21-12)10-11-20-18(22)15-7-2-3-8-16(15)19(23)24/h2-6,9,15-16,21H,7-8,10-11H2,1H3,(H,20,22)(H,23,24)
InChIKey BWNVJRYTHVWIGP-UHFFFAOYSA-N
Molecular Weight 326.396 g/mol
SMILES N(C(C1C(C(=O)O)CC=CC1)=O)CCc1c2c([nH]c1C)cccc2
SPLASH splash10-052f-1900000000-51c83bf4170a55193002
Wiley ID 1441766