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1-Propyl-4-(3-Trifluoromethanesulfonyl-phenyl)-piperazine
SpectraBase Compound ID BQKfFwD2umZ
InChI InChI=1S/C14H19F3N2O2S/c1-2-6-18-7-9-19(10-8-18)12-4-3-5-13(11-12)22(20,21)14(15,16)17/h3-5,11H,2,6-10H2,1H3
InChIKey VBKQDBLQDXWTRJ-UHFFFAOYSA-N
Mol Weight 336.37 g/mol
Molecular Formula C14H19F3N2O2S
Exact Mass 336.111934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LrYpQYKLlf
Name 1-Propyl-4-(3-Trifluoromethanesulfonyl-phenyl)-piperazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19F3N2O2S
InChI InChI=1S/C14H19F3N2O2S/c1-2-6-18-7-9-19(10-8-18)12-4-3-5-13(11-12)22(20,21)14(15,16)17/h3-5,11H,2,6-10H2,1H3
InChIKey VBKQDBLQDXWTRJ-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 5972MSD
Ionization Type EI
Molecular Weight 336.373 g/mol
SMILES C1N(CCN(C1)CCC)c1cc(ccc1)S(C(F)(F)F)(=O)=O
SPLASH splash10-0a4i-6009000000-ad7d069a4e67945d159c
Source of Spectrum IN247245B
Wiley ID 1868347