| SpectraBase Spectrum ID |
CmZOSVS4Uvg |
| Name |
Sitagliptin TMS |
| Classification |
Antidiabetic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
479.157605893 u |
| Formula |
C19H23N5OF6Si |
| InChI |
InChI=1S/C19H23F6N5OSi/c1-32(2,3)28-12(6-11-7-14(21)15(22)9-13(11)20)8-17(31)29-4-5-30-16(10-29)26-27-18(30)19(23,24)25/h7,9,12,28H,4-6,8,10H2,1-3H3 |
| InChIKey |
SMDBLXPTLREGHG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
479.502 g/mol |
| SMILES |
C(c1c(cc(c(c1)F)F)F)C(CC(N1CC[n]2c(C1)nnc2C(F)(F)F)=O)N[Si](C)(C)C |
| SPLASH |
splash10-00di-9411000000-c43e64b4ad164b7c76be |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_8455 |
