IR data for Compound 11.

DOI: 10.14469/hpc/11561 Metadata

Created: 2022-10-26 08:27

Last modified: 2024-04-02 07:00

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

IR data for (4-(Ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-olate)sodium (11)

Files

FilenameSizeTypeDescription
TM-VI-251_2022-07-19T17-59-29.pdf 60KB application/pdf IR Spectrum as PDF
11.png 16KB image/png Image structure representation
11.cdxml 9KB chemical/x-cdxml Chemdraw connection table
11.mol 3KB chemical/x-mdl-molfile MDL Molfile
11.cdxml 9KB chemical/x-cdxml Chemdraw connection table, V2

Member of collection / collaboration

DOIDescription
10.14469/hpc/11298 Compound 11: (4-(Ethoxycarbonyl)-1-(4-methoxybenzyl)-1H-pyrazol-5-olate)sodium

Subject Keywords

KeywordValue
IFD.IR IR Spectrum
inchi InChI=1S/C14H16N2O4.Na/c1-3-20-14(18)12-8-15-16(13(12)17)9-10-4-6-11(19-2)7-5-10;/h4-8,17H,3,9H2,1-2H3;/q;+1/p-1
inchikey SJXKZDLWVHUAHL-UHFFFAOYSA-M
SMILES COC(C=C1)=CC=C1CN2N=CC3=C2O[Na]O=C3OCC

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