SpectraBase Spectrum ID |
1mvD4WON3fF |
Name |
5-Hydroxytryptophan ME2TFA |
Classification |
Biomolecule |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
426.065040467 u |
Formula |
C16H12N2O5F6 |
InChI |
InChI=1S/C16H12F6N2O5/c1-28-12(25)11(24-13(26)15(17,18)19)4-7-6-23-10-3-2-8(5-9(7)10)29-14(27)16(20,21)22/h2-3,5-6,11,23H,4H2,1H3,(H,24,26) |
InChIKey |
NTNVGLNZISFPHS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
426.271 g/mol |
SMILES |
c1(ccc2[nH]cc(CC(C(OC)=O)NC(C(F)(F)F)=O)c2c1)OC(=O)C(F)(F)F |
SPLASH |
splash10-0006-3391000000-c71a8dadda880302295f |
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_10841 |