| SpectraBase Spectrum ID |
1Gm1fJxMXo |
| Name |
Melatonin artifact 2HFP |
| Classification |
Sedative |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
582.062436533 u |
| Formula |
C19H12F14N2O3 |
| InChI |
InChI=1S/C19H12F14N2O3/c1-38-9-2-3-11-10(6-9)8(4-5-34-12(36)14(20,21)16(24,25)18(28,29)30)7-35(11)13(37)15(22,23)17(26,27)19(31,32)33/h2-3,6-7H,4-5H2,1H3,(H,34,36) |
| InChIKey |
JYLZVNXJIDZKTG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
582.294 g/mol |
| SMILES |
c1(cc2c(cc1)[n](cc2CCNC(C(C(C(F)(F)F)(F)F)(F)F)=O)C(=O)C(C(C(F)(F)F)(F)F)(F)F)OC |
| SPLASH |
splash10-066r-3907000000-d72f35c426e4b6084ed7 |
| 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 |
| Synonyms |
Melatonin artifact (deacetyl-) 2HFB |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5922 |
