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1-ethyl-3-[fluoro(3,4,5-trifluorophenyl)methyl]azetidine oxalate salt
SpectraBase Compound ID H8wnvdpZtGq
InChI InChI=1S/C12H13F4N.C2H2O4/c1-2-17-5-8(6-17)11(15)7-3-9(13)12(16)10(14)4-7;3-1(4)2(5)6/h3-4,8,11H,2,5-6H2,1H3;(H,3,4)(H,5,6)
InChIKey PSOWHUKFXXWFPW-UHFFFAOYSA-N
Mol Weight 337.27 g/mol
Molecular Formula C14H15F4NO4
Exact Mass 337.093721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7eqpzy1mHkR
Name 1-ethyl-3-[fluoro(3,4,5-trifluorophenyl)methyl]azetidine oxalate salt
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15F4NO4
InChI InChI=1S/C12H13F4N.C2H2O4/c1-2-17-5-8(6-17)11(15)7-3-9(13)12(16)10(14)4-7;3-1(4)2(5)6/h3-4,8,11H,2,5-6H2,1H3;(H,3,4)(H,5,6)
InChIKey PSOWHUKFXXWFPW-UHFFFAOYSA-N
Instrument Name HP 5970A
Ionization Type EI
Molecular Weight 337.271 g/mol
SMILES C1N(CC1C(c1cc(c(c(c1)F)F)F)F)CC.OC(C(=O)O)=O
SPLASH splash10-06si-5590000000-bb966a2e953096d4d39d
Source of Spectrum WO2016185032A1
Wiley ID 1855116