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8-[2-(Ethoxycarbonylmethyl)propyl]dihydro-.beta.-carboline
SpectraBase Compound ID H4a6jooBjOZ
InChI InChI=1S/C18H22N2O2/c1-3-22-17(21)11-12(2)10-16-18-14(8-9-19-16)13-6-4-5-7-15(13)20-18/h4-7,12,20H,3,8-11H2,1-2H3
InChIKey PIWCOLTYQLHMCM-UHFFFAOYSA-N
Mol Weight 298.39 g/mol
Molecular Formula C18H22N2O2
Exact Mass 298.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpJezENYGFy
Name 8-[2-(Ethoxycarbonylmethyl)propyl]dihydro-.beta.-carboline
Alternate Name(s) 4-(4,9-Dihydro-3H-.beta.-carbolin-1-yl)-3-methyl-butyric acid ethyl ester Ethyl 4-(2,9-dihydro-1H-.beta.-carbolin-8-yl)-3-methylbutanoate
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Formula C18H22N2O2
InChI InChI=1S/C18H22N2O2/c1-3-22-17(21)11-12(2)10-16-18-14(8-9-19-16)13-6-4-5-7-15(13)20-18/h4-7,12,20H,3,8-11H2,1-2H3
InChIKey PIWCOLTYQLHMCM-UHFFFAOYSA-N
Molecular Weight 298.386 g/mol
SMILES [nH]1c2ccccc2c2c1C(=NCC2)CC(CC(=O)OCC)C
SPLASH splash10-001i-0940000000-2204d83d16903f14fe8d
Source of Spectrum F-54-10214-16
Wiley ID 808313