| SpectraBase Spectrum ID |
5zocOnyE0O |
| Name |
Methapyrilene MS3_1 |
| Comments |
F: 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/C12H13N2S/c1-2-14(10-11-6-5-9-15-11)12-7-3-4-8-13-12/h3-9H,1-2,10H2/q+1 |
| InChIKey |
ZEZNJWFSHVQLQN-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH2+]CN(CC1=CC=CS1)C1=CC=CC=N1 |
| 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 |
