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2-(6-Methoxypyridin-2-yl)-2-(6-phenylpyridin-2-yl)-2-pyridin-2-ylethyl p-toluenesulfonate
SpectraBase Compound ID 27XUHqxcgkK
InChI InChI=1S/C31H27N3O4S/c1-23-17-19-25(20-18-23)39(35,36)38-22-31(27-13-6-7-21-32-27,29-15-9-16-30(34-29)37-2)28-14-8-12-26(33-28)24-10-4-3-5-11-24/h3-21H,22H2,1-2H3
InChIKey QMNAUTLOZXEANT-UHFFFAOYSA-N
Mol Weight 537.63 g/mol
Molecular Formula C31H27N3O4S
Exact Mass 537.172228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLTsg7Yd8ki
Name 2-(6-Methoxypyridin-2-yl)-2-(6-phenylpyridin-2-yl)-2-pyridin-2-ylethyl p-toluenesulfonate
Alternate Name(s) 2-(6-Methoxy-2-pyridinyl)-2-(6-phenyl-2-pyridinyl)-2-(2-pyridinyl)ethyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H27N3O4S
InChI InChI=1S/C31H27N3O4S/c1-23-17-19-25(20-18-23)39(35,36)38-22-31(27-13-6-7-21-32-27,29-15-9-16-30(34-29)37-2)28-14-8-12-26(33-28)24-10-4-3-5-11-24/h3-21H,22H2,1-2H3
InChIKey QMNAUTLOZXEANT-UHFFFAOYSA-N
Molecular Weight 537.634 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)C(c1nc(-c2ccccc2)ccc1)(c1nc(OC)ccc1)c1ncccc1
SPLASH splash10-0udi-0009000000-aa4ef0def84e6924b539
Source of Spectrum SO-0-2490-10
Wiley ID 879010