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4-Amino-3,5-dimethyl-2,4,6-cycloheptatrien-1-one
SpectraBase Compound ID 7e774D4Sm5N
InChI InChI=1S/C9H11NO/c1-6-3-4-8(11)5-7(2)9(6)10/h3-5H,10H2,1-2H3
InChIKey XFQLSYQTIUTJCK-UHFFFAOYSA-N
Mol Weight 149.19 g/mol
Molecular Formula C9H11NO
Exact Mass 149.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hgz7yd69XeO
Name 4-Amino-3,5-dimethyl-2,4,6-cycloheptatrien-1-one
Alternate Name(s) 4-Amino-3,5-dimethyltropone 4-Amino-3,5-dimethyl-1-cyclohepta-2,4,6-trienone 4-Amino-3,5-dimethylcyclohepta-2,4,6-trien-1-one 4-Azanyl-3,5-dimethyl-cyclohepta-2,4,6-trien-1-one
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Formula C9H11NO
InChI InChI=1S/C9H11NO/c1-6-3-4-8(11)5-7(2)9(6)10/h3-5H,10H2,1-2H3
InChIKey XFQLSYQTIUTJCK-UHFFFAOYSA-N
Molecular Weight 149.193 g/mol
SMILES NC=1C(=CC(C=CC1C)=O)C
SPLASH splash10-0ab9-2900000000-2c9893b46ff2079bedb7
Source of Spectrum QE-14-632-53
Wiley ID 1691858