| SpectraBase Spectrum ID |
KD1Yjauuimk |
| Name |
Vildagliptin MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 304.30 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C17H25N3O2 |
| InChI |
InChI=1S/C17H25N3O2/c18-8-12-1-2-20(10-12)15(21)9-19-16-4-13-3-14(5-16)7-17(22,6-13)11-16/h12-14,19,22H,1-7,9-11H2/t12?,13-,14?,16?,17?/m0/s1 |
| InChIKey |
HUIMGHOWVZMLNJ-UHFFFAOYSA-N |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(CC(N1CC(CC1)C#N)=O)C12CC3CC(C[C@](C2)(C3)[H])(C1)O |
| 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 |
ms2 |
| Technique |
ITMS |
