SpectraBase Spectrum ID |
HjLpSZEWrdW |
Name |
Zolmitriptan HFB |
Classification |
Antimigraine |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
483.139288654 u |
Formula |
C20H20N3O3F7 |
InChI |
InChI=1S/C20H20F7N3O3/c1-29(2)6-5-12-9-30(16(31)18(21,22)19(23,24)20(25,26)27)15-4-3-11(8-14(12)15)7-13-10-33-17(32)28-13/h3-4,8-9,13H,5-7,10H2,1-2H3,(H,28,32) |
InChIKey |
IPNULTYONVYYPL-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
483.387 g/mol |
SMILES |
c1c2c(cc(c1)CC1COC(N1)=O)c(c[n]2C(C(F)(F)C(F)(F)C(F)(F)F)=O)CCN(C)C |
SPLASH |
splash10-0a4i-9300000000-c560e2bdce8e8539685f |
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_8135 |