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[5-Hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl Decanoate
SpectraBase Compound ID DCe6Qm1oidq
InChI InChI=1S/C18H29NO4/c1-3-4-5-6-7-8-9-10-17(21)23-13-15-11-19-14(2)18(22)16(15)12-20/h11,20,22H,3-10,12-13H2,1-2H3
InChIKey YMALMGBNMSJGFZ-UHFFFAOYSA-N
Mol Weight 323.43 g/mol
Molecular Formula C18H29NO4
Exact Mass 323.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxVAudEZ4e6
Name [5-Hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl Decanoate
Alternate Name(s) (5-hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl)methyl decanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NO4
InChI InChI=1S/C18H29NO4/c1-3-4-5-6-7-8-9-10-17(21)23-13-15-11-19-14(2)18(22)16(15)12-20/h11,20,22H,3-10,12-13H2,1-2H3
InChIKey YMALMGBNMSJGFZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1522-2675(19981216)81_12_2407
Molecular Weight 323.433 g/mol
SMILES Oc1c(ncc(c1CO)COC(CCCCCCCCC)=O)C
SPLASH splash10-0kfx-9700000000-4a87bbdd146a633e6cd6
Source of Spectrum H-81-2412-5c
Wiley ID 1787475