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2,5-Cyclohexadien-1-one, 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-
SpectraBase Compound ID 5WcZCklQodV
InChI InChI=1S/C16H19NO2/c1-17(2)12-11-16(9-7-15(19)8-10-16)13-3-5-14(18)6-4-13/h3-10,18H,11-12H2,1-2H3
InChIKey NAMOPSMXMUHDMP-UHFFFAOYSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYDkzm6nx5l
Name 2,5-Cyclohexadien-1-one, 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-
Alternate Name(s) Joubertiamine, didehydro- 4-(2-Dimethylaminoethyl)-4-(4-hydroxyphenyl)-1-cyclohexa-2,5-dienone 4-(2-Dimethylaminoethyl)-4-(4-hydroxyphenyl)cyclohexa-2,5-dien-1-one 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-2,5-cyclohexadien-1-one Dehydrojoubertiamine 4-[2-(dimethylamino)ethyl]-4-(4-hydroxyphenyl)-1-cyclohexa-2,5-dienone
CAS Registry Number 28564-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c1-17(2)12-11-16(9-7-15(19)8-10-16)13-3-5-14(18)6-4-13/h3-10,18H,11-12H2,1-2H3
InChIKey NAMOPSMXMUHDMP-UHFFFAOYSA-N
Molecular Weight 257.333 g/mol
SMILES Oc1ccc(C2(C=CC(C=C2)=O)CCN(C)C)cc1
SPLASH splash10-0ab9-9210000000-b3881973b663772f2d5f
Source of Spectrum O-11-15-3
Wiley ID 1260913