| SpectraBase Spectrum ID |
ISattKroLR4 |
| Name |
Phenprocoumon-M (HO-) MS3_1 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-230.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C12H10O4/c1-2-4-8-10(14)7-5-3-6-9(13)11(7)16-12(8)15/h3-6H,2H2,1H3,(H-,13,14,15)/p+1 |
| InChIKey |
OJOFXPKIPDEHPN-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C=CC=C2C1OC(C(=C2O)[CH+]CC)=O |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
