| SpectraBase Spectrum ID |
6BGHmrQlmg6 |
| Name |
2C-T-21 MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-240.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C11H15FNOS |
| InChI |
InChI=1S/C13H18NO3/c14-7-11(16)8-17-13-3-1-2-9-6-10(15)4-5-12(9)13/h1-4,10-11,15-16H,5-8,14H2/q+1 |
| InChIKey |
OCMUUZMUAWXIQL-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
NCC(COC1=C2C(CC([CH+]C2)O)=CC=C1)O |
| 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 |
