NMR Data for (Aqua)(ethanol) bis(4-(ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-olate)calcium (20), 1H

DOI: 10.14469/hpc/11523 Metadata

Created: 2022-10-25 09:18

Last modified: 2024-05-28 12:46

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Primary NMR data for sample 20

Files

FilenameSizeTypeDescription
20-1H.mnova 975KB chemical/x-mnova Mnova data archive
20-1H.mnpub 0 chemical/x-mnpub Mestrenova signature file for 20-1H.mnova
20-1H.zip 464KB application/zip Bruker primary data archive
20-1H.mnpub 0 chemical/x-mnpub Mestrenova signature file for 20-1H.zip
20-1H.jdx 183KB chemical/x-jcamp-dx JCAMP-DX Spectrum
20-1H.pdf 58KB application/pdf Spectrum as PDF
20.cdxml 16KB chemical/x-cdxml Chemdraw connection table
20.png 80KB image/png Image representation
20.mol 4KB chemical/x-mdl-molfile MDL Molfile
20.cdxml 16KB chemical/x-cdxml Chemdraw connection table v2
20.mol 2KB chemical/x-mdl-molfile MDL Molfile v2
20.png 56KB image/png Image representation v2

Member of collection / collaboration

DOIDescription
10.14469/hpc/11522 NMR Data for Compound 20.

Subject Keywords

KeywordValue
inchi InChI=1S/2C12H12N2O3.C2H6O.Ca.H2O/c2*1-2-17-12(16)10-8-13-14(11(10)15)9-6-4-3-5-7-9;1-2-3;;/h2*3-8,15H,2H2,1H3;3H,2H2,1H3;;1H2/q;;;+2;/p-2
inchikey DGBUVMMIXUCKAS-UHFFFAOYSA-L
NMR_Expt 1D
NMR_Nucleus 1H

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