| SpectraBase Spectrum ID |
2o11M4jzcnY |
| Name |
Naftidrofuryl-M (OH,COOH,Oxo) ME |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
328.131073739 u |
| Formula |
C19H20O5 |
| InChI |
InChI=1S/C19H20O5/c1-23-19(22)16(11-13-9-10-17(20)24-13)18(21)15-8-4-6-12-5-2-3-7-14(12)15/h2-8,13,16,18,21H,9-11H2,1H3 |
| InChIKey |
JTQCBHKVJFMARC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
328.364 g/mol |
| Nominal Mass |
328 u |
| Quality |
915 |
| Retention Index |
2445 |
| SMILES |
OC(C=1C=2C(C=CC1)=CC=CC2)C(CC1OC(CC1)=O)C(OC)=O |
| SPLASH |
splash10-0006-1900000000-79c5f2ba11c8306b22fd |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 3-hydroxy-3-(naphthalen-1-yl)-2-((5-oxooxolan-2-yl)methyl)propanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003143 |
