| SpectraBase Spectrum ID |
2oA4PXL7Vx2 |
| Name |
Buclosamide 2PFP |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
519.029517196 u |
| Formula |
C17H12ClF10NO4 |
| InChI |
InChI=1S/C17H12ClF10NO4/c1-2-3-6-29(12(31)14(19,20)16(23,24)25)11(30)9-5-4-8(18)7-10(9)33-13(32)15(21,22)17(26,27)28/h4-5,7H,2-3,6H2,1H3 |
| InChIKey |
NFBSAFRBIIFEJA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
519.723 g/mol |
| Nominal Mass |
519 u |
| Quality |
999 |
| Retention Index |
1609 |
| SMILES |
C(C(N(C(C=1C(OC(C(C(F)(F)F)(F)F)=O)=CC(=CC1)Cl)=O)CCCC)=O)(C(F)(F)F)(F)F |
| SPLASH |
splash10-0udi-1409000000-03e946e9275b1a6778c9 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-(butyl(2,2,3,3,3-pentafluoropropanoyl)carbamoyl)-5-chlorophenyl 2,2,3,3,3-pentafluoropropanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011669 |
