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3-(N-BENZYLANILINO)-6,6-DIMETHYLCYCLOHEX-2-ENONE
SpectraBase Compound ID 6dqn59tswHO
InChI InChI=1S/C21H23NO/c1-21(2)14-13-19(15-20(21)23)22(18-11-7-4-8-12-18)16-17-9-5-3-6-10-17/h3-12,15H,13-14,16H2,1-2H3
InChIKey XKCKORWPVFBJMY-UHFFFAOYSA-N
Mol Weight 305.42 g/mol
Molecular Formula C21H23NO
Exact Mass 305.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVOiiSrGgAl
Name 3-(N-benzylanilino)-6,6-dimethyl-cyclohex-2-en-1-one
Alternate Name(s) 6,6-Dimethyl-3-(N-(phenylmethyl)anilino)-1-cyclohex-2-enone 6,6-Dimethyl-3-[phenyl-(phenylmethyl)amino]cyclohex-2-en-1-one
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Formula C21H23NO
InChI InChI=1S/C21H23NO/c1-21(2)14-13-19(15-20(21)23)22(18-11-7-4-8-12-18)16-17-9-5-3-6-10-17/h3-12,15H,13-14,16H2,1-2H3
InChIKey XKCKORWPVFBJMY-UHFFFAOYSA-N
Molecular Weight 305.421 g/mol
SMILES C1(=CC(=O)C(CC1)(C)C)N(Cc1ccccc1)c1ccccc1
SPLASH splash10-0007-9341000000-7c5fdd1f50222df0573d
Source of Spectrum AC-1994-70-6
Wiley ID 811762