| SpectraBase Spectrum ID |
IafQkglgubm |
| Name |
MPHP-M (HOOC-sidechain) MS3_2 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-200.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C13H17O/c1-3-4-5-6-13(14)12-9-7-11(2)8-10-12/h6-10H,3-5H2,1-2H3/q+1 |
| InChIKey |
ADSRJSKAUNOJAW-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH+](C(C=1C=CC(=CC1)C)=O)CCCC |
| 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 |
