SpectraBase Spectrum ID |
2mL0UWbCeau |
Name |
N,N'-Di(trifluoroacetyl)histamine |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
303.044245453 u |
Formula |
C9H7F6N3O2 |
InChI |
InChI=1S/C9H7F6N3O2/c10-8(11,12)6(19)17-2-1-5-3-16-4-18(5)7(20)9(13,14)15/h3-4H,1-2H2,(H,17,19) |
InChIKey |
CBGZKJOWTZSEAY-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
303.164 g/mol |
Nominal Mass |
303 u |
Quality |
960 |
Retention Index |
2303 |
SMILES |
C(N1C(CCNC(C(F)(F)F)=O)=CN=C1)(C(F)(F)F)=O |
SPLASH |
splash10-0006-6900000000-a44845a17e4db3cbf957 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
trifluoro-N-(2-(1-(trifluoroacetyl)-1H-imidazol-5-yl)ethyl)acetamide |
Technique |
GC/MS |
Wiley ID |
DD2024_027586 |