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

*Links on SpectraBase are not permalinks.
3-[(3,5-difluorophenyl)(fluoro)methyl]-1-propylazetidine oxalate salt
SpectraBase Compound ID FgUQHy9Lj4G
InChI InChI=1S/C13H16F3N.C2H2O4/c1-2-3-17-7-10(8-17)13(16)9-4-11(14)6-12(15)5-9;3-1(4)2(5)6/h4-6,10,13H,2-3,7-8H2,1H3;(H,3,4)(H,5,6)
InChIKey BBEAVVKNQCZFCR-UHFFFAOYSA-N
Mol Weight 333.31 g/mol
Molecular Formula C15H18F3NO4
Exact Mass 333.118793 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 KP7GUIjePpo
Name 3-[(3,5-difluorophenyl)(fluoro)methyl]-1-propylazetidine oxalate salt
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18F3NO4
InChI InChI=1S/C13H16F3N.C2H2O4/c1-2-3-17-7-10(8-17)13(16)9-4-11(14)6-12(15)5-9;3-1(4)2(5)6/h4-6,10,13H,2-3,7-8H2,1H3;(H,3,4)(H,5,6)
InChIKey BBEAVVKNQCZFCR-UHFFFAOYSA-N
Instrument Name HP 5970A
Ionization Type EI
Molecular Weight 333.307 g/mol
SMILES OC(C(=O)O)=O.c1c(F)cc(C(C2CN(CCC)C2)F)cc1F
SPLASH splash10-03di-0190000000-1df121281b214a995c92
Source of Spectrum WO2016185032A1
Wiley ID 1855110