| SpectraBase Spectrum ID |
26wwesGb2XO |
| Name |
alpha-PHP MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-190.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C12H15O |
| InChI |
InChI=1S/C15H11Cl2N2/c1-19-9-18-15(11-4-2-3-5-13(11)17)12-8-10(16)6-7-14(12)19/h2-9H,1H3/q+1 |
| InChIKey |
BQGXEADMTDXUET-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
C1=C2C(=CC(=C1)Cl)C(=N[CH+]N2C)C=1C(=CC=CC1)Cl |
| 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 |
