| SpectraBase Spectrum ID |
CNUCCeyWDKc |
| Name |
25I-NBOMe-M (O,O,O-tris-demethyl-) MS3_2 |
| Comments |
T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-275.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C8H7IO2/c1-2-5-3-8(11)6(9)4-7(5)10/h3-4H,1-2H2,(H-,10,11)/p+1 |
| InChIKey |
WEDXUZFAFLUBBX-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC1=CC(=C(C=C1I)O)C[CH2+] |
| 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 |
