| SpectraBase Spectrum ID |
DD8J08rHVkJ |
| Name |
AM-2233-M (nor-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 445.30 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C21H21IN2O |
| InChI |
InChI=1S/C21H21IN2O/c22-19-10-3-1-9-17(19)21(25)18-14-24(13-15-7-5-6-12-23-15)20-11-4-2-8-16(18)20/h1-4,8-11,14-15,23H,5-7,12-13H2 |
| InChIKey |
ZKQRKKZWWCICDA-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N1CCCCC1CN1C=2C(=CC=CC2)C(=C1)C(=O)C1=C(C=CC=C1)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: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
