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[(4-BENZYL-1-PHTHALAZINYL)THIO]ACETIC ACID, METHYL ESTER

View entire compound with spectra: 1 NMR, and 1 FTIR

[(4-BENZYL-1-PHTHALAZINYL)THIO]ACETIC ACID, METHYL ESTER
SpectraBase Compound ID 7T5jr9VhMYE
InChI InChI=1S/C18H16N2O2S/c1-22-17(21)12-23-18-15-10-6-5-9-14(15)16(19-20-18)11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3
InChIKey AFQMMBOQZXDBCL-UHFFFAOYSA-N
Mol Weight 324.4 g/mol
Molecular Formula C18H16N2O2S
Exact Mass 324.093249 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I4t9ETsjkaA
Name [(4-BENZYL-1-PHTHALAZINYL)THIO]ACETIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2O2S
InChI InChI=1S/C18H16N2O2S/c1-22-17(21)12-23-18-15-10-6-5-9-14(15)16(19-20-18)11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3
InChIKey AFQMMBOQZXDBCL-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 120-122C
Molecular Weight 324.40
Solvent CDCl3; Reference=TMS; Temperature 297K