SpectraBase Spectrum ID |
2oVIUJldrge |
Name |
Pyridoxine 3PFP |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
607.011209421 u |
Formula |
C17H8F15NO6 |
InChI |
InChI=1S/C17H8F15NO6/c1-5-8(39-11(36)14(22,23)17(30,31)32)7(4-38-10(35)13(20,21)16(27,28)29)6(2-33-5)3-37-9(34)12(18,19)15(24,25)26/h2H,3-4H2,1H3 |
InChIKey |
CFDVSLYQVZBIGX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
607.228 g/mol |
Nominal Mass |
607 u |
Quality |
998 |
Retention Index |
1354 |
SMILES |
C(C(OC1=C(C(COC(C(C(F)(F)F)(F)F)=O)=CN=C1C)COC(C(C(F)(F)F)(F)F)=O)=O)(C(F)(F)F)(F)F |
SPLASH |
splash10-014i-6922100000-57f890a8afd2628d1847 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Vitamin B6 3PFP
2-methyl-4,5-bis(((2,2,3,3,3-pentafluoropropanoyl)oxy)methyl)pyridin-3-yl 2,2,3,3,3-\rpentafluoropropanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_009940 |