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5"-Methyl-5-(3-methanosulfonyl-1-propyl)-2,2':6',2"-terpyridine
SpectraBase Compound ID 4LP5HTGRcez
InChI InChI=1S/C20H21N3O3S/c1-15-8-10-17(21-13-15)19-6-3-7-20(23-19)18-11-9-16(14-22-18)5-4-12-26-27(2,24)25/h3,6-11,13-14H,4-5,12H2,1-2H3
InChIKey OXTTWXVERAKZFF-UHFFFAOYSA-N
Mol Weight 383.47 g/mol
Molecular Formula C20H21N3O3S
Exact Mass 383.130363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EuMCj335jNf
Name 5"-Methyl-5-(3-methanosulfonyl-1-propyl)-2,2':6',2"-terpyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O3S
InChI InChI=1S/C20H21N3O3S/c1-15-8-10-17(21-13-15)19-6-3-7-20(23-19)18-11-9-16(14-22-18)5-4-12-26-27(2,24)25/h3,6-11,13-14H,4-5,12H2,1-2H3
InChIKey OXTTWXVERAKZFF-UHFFFAOYSA-N
Molecular Weight 383.466 g/mol
SMILES C(OS(=O)(=O)C)CCc1cnc(-c2nc(-c3ncc(cc3)C)ccc2)cc1
SPLASH splash10-0080-0092000000-d19796e7258743ee3bf6
Source of Spectrum C-119-2663-4
Synonyms 5''-Methyl-5-(3-methanosulfonyl-1-propyl)-2,2':6',2''-terpyridine
Wiley ID 760199