| SpectraBase Spectrum ID |
5so0lQCJNCk |
| Name |
Zolmitriptan 2HFB |
| Classification |
Antimigraine |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
679.115200382 u |
| Formula |
C24H19N3O4F14 |
| InChI |
InChI=1S/C24H19F14N3O4/c1-39(2)6-5-12-9-40(16(42)19(25,26)21(29,30)23(33,34)35)15-4-3-11(8-14(12)15)7-13-10-45-18(44)41(13)17(43)20(27,28)22(31,32)24(36,37)38/h3-4,8-9,13H,5-7,10H2,1-2H3 |
| InChIKey |
ZMBVEERDMKMFQR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
679.411 g/mol |
| SMILES |
c1cc(CC2COC(N2C(C(F)(F)C(F)(F)C(F)(F)F)=O)=O)cc2c(c[n](C(C(F)(F)C(F)(F)C(F)(F)F)=O)c12)CCN(C)C |
| SPLASH |
splash10-0a4i-9400000000-2d0a27d87b0a69efd4e4 |
| 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_8134 |
