| SpectraBase Spectrum ID |
CQ2d5y7b17q |
| Name |
Kavain MS3_2 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C13H13O/c1-12(14-2)8-6-7-11-13-9-4-3-5-10-13/h3-7,9-11H,1H2,2H3/q+1/b11-7+ |
| InChIKey |
SPWCXEDRNOCWIW-YRNVUSSQSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C(=[C+]C(=C)OC)\C=C\C=1C=CC=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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
