| SpectraBase Spectrum ID |
9onkpvvF5c |
| Name |
5-IAI MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-255.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C9H7I |
| InChI |
InChI=1S/C9H8I/c10-9-5-4-7-2-1-3-8(7)6-9/h1,4-6H,2-3H2/q+1 |
| InChIKey |
PWEGOWIWASJHCC-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
[CH+]1CC=2C(C1)=CC=C(C2)I |
| 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: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
