| SpectraBase Spectrum ID |
K4PDk5QqZ3X |
| Name |
Abacavir-M (COOH) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-270.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| InChI |
InChI=1S/C13H15N6/c14-13-17-11(16-8-5-6-8)10-12(18-13)19(7-15-10)9-3-1-2-4-9/h1,4,7-8H,2-3,5-6H2,(H3,14,16,17,18)/q+1 |
| InChIKey |
GFTUKZFGJZNVSQ-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C=1C=2N=CN(C2N=C(N1)N)C=1C[CH+]CC1)C1CC1 |
| 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 |
ms3 |
| Technique |
ITMS |
