| SpectraBase Spectrum ID |
63lnz6y7kOD |
| Name |
25B-NBOMe-M (N-dealkyl-O-demethyl-) isomer-2 |
| Collision Gas |
N2 |
| Comments |
FTMS + p ESI d Full ms2 [email protected] [50.00-270.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C9H12BrNO2 |
| InChI |
InChI=1S/C9H12BrNO2/c1-13-9-5-7(10)8(12)4-6(9)2-3-11/h4-5,12H,2-3,11H2,1H3 |
| InChIKey |
OYMGZEIXHQCXLO-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
P |
| Ionization Type |
HESI |
| Precursor Ion |
[M+H]+ |
| SMILES |
OC1=CC(CCN)=C(C=C1Br)OC |
| Sample Comments |
The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar |
| Spectrum Type |
ms2 |
| Technique |
HCD |
