| SpectraBase Spectrum ID |
JNZRMOFXcVS |
| Name |
DOI artifact (deamino-) |
| 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 |
C11H13IO2 |
| InChI |
InChI=1S/C11H14IO2/c1-4-5-8-6-11(14-3)9(12)7-10(8)13-2/h4,6-7H,5H2,1-3H3/q+1 |
| InChIKey |
MCADUWGUTGPDPD-UHFFFAOYSA-N |
| Inlet Type |
UHPLC |
| Instrument Name |
Thermo Fisher Q Exactive Orbitrap |
| Ion Polarity |
P |
| Ionization Type |
HESI |
| Precursor Ion |
[M+H]+ |
| SMILES |
[CH+](CC=1C(=CC(=C(C1)OC)I)OC)C |
| 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 |
