| SpectraBase Spectrum ID |
BY34z26wlVp |
| Name |
Clobutinol-M (nor-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 242.10 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C13H20ClNO |
| InChI |
InChI=1S/C13H20ClNO/c1-10(9-15-3)13(2,16)8-11-4-6-12(14)7-5-11/h4-7,10,15-16H,8-9H2,1-3H3 |
| InChIKey |
TYTWIESIKSLBEC-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(CC(C(CC1=CC=C(C=C1)Cl)(O)C)C)C |
| 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 |
