| SpectraBase Spectrum ID |
6UzYnX93Hk |
| Name |
Pipamperone-M (dehydro-HO-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 390.20 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C21H28FN3O3 |
| InChI |
InChI=1S/C21H28FN3O3/c22-17-5-3-16(4-6-17)19(27)2-1-11-24-14-9-21(10-15-24,20(23)28)25-12-7-18(26)8-13-25/h3-6,9,14,18,26H,1-2,7-8,10-13,15H2,(H2,23,28) |
| InChIKey |
NHNOIXRJTMSTEO-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC1CCN(C2(C(N)=O)CCN(CCCC(C=3C=CC(=CC3)F)=O)C=C2)CC1 |
| 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 |
ms2 |
| Technique |
ITMS |
