SpectraBase Spectrum ID |
5CvXbcDl7yI |
Name |
Granisetron-M (nor-) MS2 |
Comments |
F: ITMS + c ESI d w Full ms2 299.10 |
Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
Formula |
C17H22N4O |
InChI |
InChI=1S/C17H22N4O/c1-21-15-8-3-2-7-14(15)16(20-21)17(22)19-13-9-11-5-4-6-12(10-13)18-11/h2-3,7-8,11-13,18H,4-6,9-10H2,1H3,(H,19,22)/t11-,12+,13+ |
InChIKey |
VIGVTDRZHFWDBM-UHFFFAOYSA-N |
Ion Polarity |
P |
Ionization Type |
ESI |
SMILES |
N(C(C=1C2=C(N(C)N1)C=CC=C2)=O)[C@]1(C[C@@]2(CCC[C@](C1)(N2)[H])[H])[H] |
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 |