| SpectraBase Spectrum ID |
3ZH3SlQmZ3V |
| Name |
Melatonin HFB |
| Classification |
Sedative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
428.097089489 u |
| Formula |
C17H15F7N2O3 |
| InChI |
InChI=1S/C17H15F7N2O3/c1-9(27)25-6-5-10-8-26(13-4-3-11(29-2)7-12(10)13)14(28)15(18,19)16(20,21)17(22,23)24/h3-4,7-8H,5-6H2,1-2H3,(H,25,27) |
| InChIKey |
RMHDFPSXAGLPGZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
428.307 g/mol |
| SMILES |
c1(cc2c(cc1)[n](cc2CCNC(C)=O)C(=O)C(C(C(F)(F)F)(F)F)(F)F)OC |
| SPLASH |
splash10-014i-1409100000-cd4b3ffbdd895ddf9318 |
| 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_5921 |
