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3-(3-Amino-4-methyl-phenyl)-3,4,4-trimethyl-cyclopentanone
SpectraBase Compound ID ERkhMQt5sy8
InChI InChI=1S/C15H21NO/c1-10-5-6-11(7-13(10)16)15(4)9-12(17)8-14(15,2)3/h5-7H,8-9,16H2,1-4H3
InChIKey NJBCZEJZUOOZFR-UHFFFAOYSA-N
Mol Weight 231.34 g/mol
Molecular Formula C15H21NO
Exact Mass 231.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CesbqUj3fDN
Name 3-(3-Amino-4-methyl-phenyl)-3,4,4-trimethyl-cyclopentanone
Alternate Name(s) 3-(3-amino-4-methylphenyl)-3,4,4-trimethyl-1-cyclopentanone 3-(3-amino-4-methylphenyl)-3,4,4-trimethylcyclopentan-1-one 3-(3-azanyl-4-methyl-phenyl)-3,4,4-trimethyl-cyclopentan-1-one
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Formula C15H21NO
InChI InChI=1S/C15H21NO/c1-10-5-6-11(7-13(10)16)15(4)9-12(17)8-14(15,2)3/h5-7H,8-9,16H2,1-4H3
InChIKey NJBCZEJZUOOZFR-UHFFFAOYSA-N
Molecular Weight 231.339 g/mol
SMILES Nc1cc(ccc1C)C1(CC(=O)CC1(C)C)C
SPLASH splash10-0002-5900000000-0a1389bf19b640878ebd
Wiley ID 1489848