SpectraBase Spectrum ID |
8rYV2jBuruf |
Name |
Rizatriptan-M (deamino-HO-) 2TFA |
Classification |
Serotoninergic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
434.081359237 u |
Formula |
C17H12F6N4O3 |
InChI |
InChI=1S/C17H12F6N4O3/c18-16(19,20)14(28)27-7-11(3-4-30-15(29)17(21,22)23)12-5-10(1-2-13(12)27)6-26-9-24-8-25-26/h1-2,5,7-9H,3-4,6H2 |
InChIKey |
IEOWQPGAGRLRBW-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
434.298 g/mol |
SMILES |
C(OC(C(F)(F)F)=O)Cc1c[n](C(C(F)(F)F)=O)c2c1cc(C[n]1ncnc1)cc2 |
SPLASH |
splash10-0a4i-2829200000-94586fea01409d3cdecb |
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_5847 |