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2-(N,N-DIMETHYLAMINOMETHYLENE)-CYClOHEPTANONE
SpectraBase Compound ID KakWT1oSfyy
InChI InChI=1S/C10H17NO/c1-11(2)8-9-6-4-3-5-7-10(9)12/h8H,3-7H2,1-2H3/b9-8+
InChIKey QEFBVPUSEYVJMG-CMDGGOBGSA-N
Mol Weight 167.25 g/mol
Molecular Formula C10H17NO
Exact Mass 167.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dti8rp4uEe0
Name (E)-2-((Dimethylamino)methylene)cycloheptanone
Appearance Gray viscous oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO
InChI InChI=1S/C10H17NO/c1-11(2)8-9-6-4-3-5-7-10(9)12/h8H,3-7H2,1-2H3/b9-8+
InChIKey QEFBVPUSEYVJMG-CMDGGOBGSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00148
Molecular Weight 167.252 g/mol
SMILES CN(C)\C=C\1C(CCCCC1)=O
SPLASH splash10-052f-9200000000-74f7c26f4210664e7eb6
Source of Spectrum JOC-86-SM18-2(5)
Wiley ID 1867742