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2-(2-acetoxy-4-(4-methylbenzenesulfonate)phenyl)pyrimidine
SpectraBase Compound ID 5RvRP7gYuub
InChI InChI=1S/C19H16N2O5S/c1-13-4-7-16(8-5-13)27(23,24)26-15-6-9-17(18(12-15)25-14(2)22)19-20-10-3-11-21-19/h3-12H,1-2H3
InChIKey YXRTVWKMEGMRKI-UHFFFAOYSA-N
Mol Weight 384.41 g/mol
Molecular Formula C19H16N2O5S
Exact Mass 384.077993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ew4MwAKzeh
Name 2-(2-acetoxy-4-(4-methylbenzenesulfonate)phenyl)pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2O5S
InChI InChI=1S/C19H16N2O5S/c1-13-4-7-16(8-5-13)27(23,24)26-15-6-9-17(18(12-15)25-14(2)22)19-20-10-3-11-21-19/h3-12H,1-2H3
InChIKey YXRTVWKMEGMRKI-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 384.406 g/mol
SMILES c1c(-c2ncccn2)c(OC(=O)C)cc(OS(c2ccc(C)cc2)(=O)=O)c1
SPLASH splash10-0006-5609000000-2e2967796041be3b034b
Source of Spectrum CN101812022A
Wiley ID 1841674