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2-Dodecanone, 12-(5-methoxy-6-methyl-2-pyridinyl)-
SpectraBase Compound ID B0XLHUuBTLt
InChI InChI=1S/C19H31NO2/c1-16(21)12-10-8-6-4-5-7-9-11-13-18-14-15-19(22-3)17(2)20-18/h14-15H,4-13H2,1-3H3
InChIKey GHZSFYQINGBXEX-UHFFFAOYSA-N
Mol Weight 305.46 g/mol
Molecular Formula C19H31NO2
Exact Mass 305.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDfnFxkHDvi
Name 2-Dodecanone, 12-(5-methoxy-6-methyl-2-pyridinyl)-
Alternate Name(s) 12-(5-methoxy-6-methyl-2-pyridinyl)-2-dodecanone 4-Deoxymelochininone 4-Deoxymeloquinone O-methyldehydrocassine
CAS Registry Number 77386-65-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31NO2
InChI InChI=1S/C19H31NO2/c1-16(21)12-10-8-6-4-5-7-9-11-13-18-14-15-19(22-3)17(2)20-18/h14-15H,4-13H2,1-3H3
InChIKey GHZSFYQINGBXEX-UHFFFAOYSA-N
Molecular Weight 305.462 g/mol
SMILES c1(nc(ccc1OC)CCCCCCCCCCC(=O)C)C
SPLASH splash10-000i-1900000000-358a298bb803bed9fa5b
Source of Spectrum K-114-816-0
Wiley ID 1307461