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Trimethoprim 3-hydroxy-2-naphthoate

View entire compound with spectra: 2 NMR, and 1 FTIR

Trimethoprim 3-hydroxy-2-naphthoate
SpectraBase Compound ID FDpViKCBwVZ
InChI InChI=1S/C14H18N4O3.C11H8O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h5-7H,4H2,1-3H3,(H4,15,16,17,18);1-6,12H,(H,13,14)
InChIKey SEPMVQKBHWVOMU-UHFFFAOYSA-N
Mol Weight 478.5 g/mol
Molecular Formula C25H26N4O6
Exact Mass 478.185235 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID K2EH7Gq6V3j
Name Trimethoprim 3-hydroxy-2-naphthoate
Source of Sample Aldrich
Catalog Number 346381
CAS Registry Number 304671-81-6
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N4O6
InChI InChI=1S/C14H18N4O3.C11H8O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h5-7H,4H2,1-3H3,(H4,15,16,17,18);1-6,12H,(H,13,14)
InChIKey SEPMVQKBHWVOMU-UHFFFAOYSA-N
Purity 98%
Synonyms 5-(3,4,5-Trimethoxybenzyl)-2,4-pyrimidinediamine naphthoate, Trimethoprim naphthoate
Wiley ID SIAL_ATR-IR_016414