| SpectraBase Spectrum ID |
JJvQ4q4e2mT |
| Name |
Pyridoxine |
| CAS Registry Number |
65-23-6 |
| Collision Energy |
25 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
169.073893215 u |
| Formula |
C8H11NO3 |
| InChI |
InChI=1S/C8H11NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,10-12H,3-4H2,1H3 |
| InChIKey |
LXNHXLLTXMVWPM-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
169.180 g/mol |
| Nominal Mass |
169 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
170.081 |
| SMILES |
OC=1C(=NC=C(C1CO)CO)C |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_821.4 |
