For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
CP-A 2HFB
SpectraBase Compound ID 1pfmjnNWiUK
InChI InChI=1S/C18H13F14NO5/c1-36-8-5-7(3-4-33-11(34)13(19,20)15(23,24)17(27,28)29)6-9(37-2)10(8)38-12(35)14(21,22)16(25,26)18(30,31)32/h5-6H,3-4H2,1-2H3,(H,33,34)
InChIKey SOVFQKGCZSBPCC-UHFFFAOYSA-N
Mol Weight 589.28 g/mol
Molecular Formula C18H13F14NO5
Exact Mass 589.057017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8GguzHAIN60
Name CP-A 2HFB
Classification Phenethylamine designer drug derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 589.057016800 u
Formula C18H13F14NO5
InChI InChI=1S/C18H13F14NO5/c1-36-8-5-7(3-4-33-11(34)13(19,20)15(23,24)17(27,28)29)6-9(37-2)10(8)38-12(35)14(21,22)16(25,26)18(30,31)32/h5-6H,3-4H2,1-2H3,(H,33,34)
InChIKey SOVFQKGCZSBPCC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 589.282 g/mol
Nominal Mass 589 u
Quality 987
Retention Index 1863
SMILES C(C(C(NCCC1=CC(=C(C(=C1)OC)OC(C(C(C(F)(F)F)(F)F)(F)F)=O)OC)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-004i-4905000000-128228986873f6caa8b0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,2,3,3,4,4,4-Heptafluoro-N-(2-(4-perfluorobutyloxy-3,5-dimethoxyphenyl)ethyl)butanamide
Technique GC/MS
Wiley ID DD2024_022199