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5,5-Dimethyl-2-(octylaminomethylene)-1,3-cyclohexanedione
SpectraBase Compound ID GdDuSFqDSiY
InChI InChI=1S/C17H29NO2/c1-4-5-6-7-8-9-10-18-13-14-15(19)11-17(2,3)12-16(14)20/h13,18H,4-12H2,1-3H3
InChIKey YHCVTVDFRXHTMX-UHFFFAOYSA-N
Mol Weight 279.42 g/mol
Molecular Formula C17H29NO2
Exact Mass 279.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7y0PopAgsmx
Name 5,5-Dimethyl-2-(octylaminomethylene)-1,3-cyclohexanedione
CAS Registry Number 104899-82-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H29NO2
InChI InChI=1S/C17H29NO2/c1-4-5-6-7-8-9-10-18-13-14-15(19)11-17(2,3)12-16(14)20/h13,18H,4-12H2,1-3H3
InChIKey YHCVTVDFRXHTMX-UHFFFAOYSA-N
Molecular Weight 279.424 g/mol
SMILES N(C=C1C(CC(CC1=O)(C)C)=O)CCCCCCCC
SPLASH splash10-0006-9620000000-23b8f733f1ee838fae14
Source of Spectrum AD-0-2532-0
Synonyms 5,5-Dimethyl-2-[(octylamino)methylene]cyclohexane-1,3-dione 5,5-Dimethyl-2-[(octylamino)methylene]cyclohexane-1,3-quinone 5,5-Dimethyl-2-[(octylamino)methylidene]cyclohexane-1,3-dione
Wiley ID 1422197