| SpectraBase Spectrum ID |
AJIeRgamxOW |
| Name |
25I-NBOMe-M (N-dealkyl-deamino-HOOC-O-demethyl-)_neg |
| Collision Gas |
N2 |
| Comments |
FTMS - p ESI d Full ms2 [email protected] [50.00-330.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C9H9IO4 |
| InChI |
InChI=1S/C9H9IO4/c1-14-8-2-5(3-9(12)13)7(11)4-6(8)10/h2,4,11H,3H2,1H3,(H,12,13) |
| InChIKey |
JILSRUDTIBXZRZ-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
N |
| Ionization Type |
HESI |
| Precursor Ion |
[M-H]- |
| SMILES |
OC=1C=C(C(=CC1CC(O)=O)OC)I |
| 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 |
