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3-{[2-(1H-indol-3-yl)ethyl]amino}-5,5-dimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 8JDaoFQWQS5
InChI InChI=1S/C18H22N2O/c1-18(2)10-14(9-15(21)11-18)19-8-7-13-12-20-17-6-4-3-5-16(13)17/h3-6,9,12,19-20H,7-8,10-11H2,1-2H3
InChIKey DOACMWMKBQGINY-UHFFFAOYSA-N
Mol Weight 282.39 g/mol
Molecular Formula C18H22N2O
Exact Mass 282.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xwIEUFZPKE
Name 3-[2-(1H-indol-3-yl)ethylamino]-5,5-dimethyl-1-cyclohex-2-enone
Alternate Name(s) 3-[2-(1H-indol-3-yl)ethylamino]-5,5-dimethyl-cyclohex-2-en-1-one Cyclohex-2-enone, 3-[2-(1H-indol-3-yl)ethylamino]-5,5-dimethyl-
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Formula C18H22N2O
InChI InChI=1S/C18H22N2O/c1-18(2)10-14(9-15(21)11-18)19-8-7-13-12-20-17-6-4-3-5-16(13)17/h3-6,9,12,19-20H,7-8,10-11H2,1-2H3
InChIKey DOACMWMKBQGINY-UHFFFAOYSA-N
Molecular Weight 282.387 g/mol
SMILES [nH]1c2c(c(CCNC3=CC(=O)CC(C3)(C)C)c1)cccc2
SPLASH splash10-001u-9700000000-c39457a7e222ea51d47a
Wiley ID 1439175