| SpectraBase Spectrum ID |
DvSrD0pA2xb |
| Name |
25C-NBOMe-M (O-demethyl-) isomer 2 MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-215.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C9H11ClNO2 |
| InChI |
InChI=1S/C9H10ClNO2/c1-13-9-4-6(2-3-11)8(12)5-7(9)10/h3-5,11-12H,2H2,1H3/p+1 |
| InChIKey |
MYOJBZJQYAVSMN-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC=1C=C(C(=CC1CC=[NH2+])OC)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: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
