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Trifluoromethanesulfonic acid 4-(1-Propylpiperodin-3-yl)phenyl ester
SpectraBase Compound ID DqtdWltrzCI
InChI InChI=1S/C15H20F3NO3S/c1-2-9-19-10-3-4-13(11-19)12-5-7-14(8-6-12)22-23(20,21)15(16,17)18/h5-8,13H,2-4,9-11H2,1H3/t13-/m1/s1
InChIKey QBBNRIPQRWMMNR-CYBMUJFWSA-N
Mol Weight 351.38 g/mol
Molecular Formula C15H20F3NO3S
Exact Mass 351.111599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tGHkBJVtDJ
Name Trifluoromethanesulfonic acid 4-(1-Propylpiperodin-3-yl)phenyl ester
Alternate Name(s) Trifluoromethanesulfonic acid [4-[(3S)-1-propyl-3-piperidinyl]phenyl] ester [4-[(3S)-1-propylpiperidin-3-yl]phenyl] trifluoromethanesulfonate [4-[(3S)-1-propyl-3-piperidyl]phenyl] trifluoromethanesulfonate [4-[(3S)-1-propylpiperidin-3-yl]phenyl] tris(fluoranyl)methanesulfonate
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Formula C15H20F3NO3S
InChI InChI=1S/C15H20F3NO3S/c1-2-9-19-10-3-4-13(11-19)12-5-7-14(8-6-12)22-23(20,21)15(16,17)18/h5-8,13H,2-4,9-11H2,1H3/t13-/m1/s1
InChIKey QBBNRIPQRWMMNR-CYBMUJFWSA-N
Molecular Weight 351.384 g/mol
SMILES C(S(Oc1ccc([C@]2(CN(CCC)CCC2)[H])cc1)(=O)=O)(F)(F)F
SPLASH splash10-00di-3109000000-5dd6e350941f69e83ffb
Source of Spectrum E1-37-2750-43
Wiley ID 1575246