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2-(4-Tosylpiperazin-1-yl)pyrimidine
SpectraBase Compound ID 5JuiTS9VzLw
InChI InChI=1S/C15H18N4O2S/c1-13-3-5-14(6-4-13)22(20,21)19-11-9-18(10-12-19)15-16-7-2-8-17-15/h2-8H,9-12H2,1H3
InChIKey VSPWPLLVPZWAEN-UHFFFAOYSA-N
Mol Weight 318.4 g/mol
Molecular Formula C15H18N4O2S
Exact Mass 318.115047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9bE00iiUlh
Name 2-(4-Tosylpiperazin-1-yl)pyrimidine
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.115047008 u
Formula C15H18N4O2S
InChI InChI=1S/C15H18N4O2S/c1-13-3-5-14(6-4-13)22(20,21)19-11-9-18(10-12-19)15-16-7-2-8-17-15/h2-8H,9-12H2,1H3
InChIKey VSPWPLLVPZWAEN-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201810548
Molecular Weight 318.395 g/mol
Quality 137
Reported Formula C15H18N4O2S
SMILES C1(S(N2CCN(CC2)C2=NC=CC=N2)(=O)=O)=CC=C(C=C1)C
SPLASH splash10-03di-0901000000-4cbd6067804e99554412
Source of Spectrum ACI-57-SM12-6e (DOI: 10.1002/anie.201810548)
Thin-Layer Chromatography 0.24 (pentane/EtOAc, 2:1)
Wiley ID 1893590