| SpectraBase Spectrum ID |
DkM1wTUdloW |
| Name |
Melatonin 2TFA |
| Classification |
Circadian rhythms hormone derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
424.085775913 u |
| Formula |
C17H14F6N2O4 |
| InChI |
InChI=1S/C17H14F6N2O4/c1-9(26)24(14(27)16(18,19)20)6-5-10-8-25(15(28)17(21,22)23)13-4-3-11(29-2)7-12(10)13/h3-4,7-8H,5-6H2,1-2H3 |
| InChIKey |
OBGMYDIQXWZJOO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
424.299 g/mol |
| Nominal Mass |
424 u |
| Quality |
829 |
| Retention Index |
3151 |
| SMILES |
C=12C(C(=CN2C(C(F)(F)F)=O)CCN(C(C(F)(F)F)=O)C(=O)C)=CC(=CC1)OC |
| SPLASH |
splash10-01bd-1691100000-e735a68f40b969e1248e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(2-(5-methoxy-1-(trifluoroacetyl)-1H-indol-3-yl)ethyl)-N-(trifluoroacetyl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011490 |
