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N-Methyl-1H-azepin-3(2H)-one
SpectraBase Compound ID 2kCEZ6SDkl8
InChI InChI=1S/C7H9NO/c1-8-5-3-2-4-7(9)6-8/h2-5H,6H2,1H3
InChIKey LTANNPUVXNXEFX-UHFFFAOYSA-N
Mol Weight 123.15 g/mol
Molecular Formula C7H9NO
Exact Mass 123.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 80ShdOTVMq9
Name 3H-Azepin-3-one, 1,2-dihydro-1-methyl-
CAS Registry Number 110561-67-6
Comments Less than 3 mono-isotopic peaks
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Formula C7H9NO
InChI InChI=1S/C7H9NO/c1-8-5-3-2-4-7(9)6-8/h2-5H,6H2,1H3
InChIKey LTANNPUVXNXEFX-UHFFFAOYSA-N
Molecular Weight 123.155 g/mol
SMILES C=1N(CC(C=CC1)=O)C
SPLASH splash10-006x-9500000000-82956d3c29b62b404fd0
Source of Spectrum KC-1989-427-7
Synonyms 1-methyl-1,2-dihydro-3H-azepin-3-one 1-Methyl-1H-azepin-4,6-dien-3(2H)-one 1-Methyl-1H-azepine-3(2H)-one
Wiley ID 1128435