Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

Chemical Info

InChI	InChI=1S/C39H32OP2.C11H8BrN2.Cu/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32;12-9-3-5-10(6-4-9)14-8-11-2-1-7-13-11;/h3-28H,1-2H3;1-8H;/q;-1;+1/b;14-8+;
SMILES	CC1(C)c2cccc(c2Oc2c1cccc2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.Brc1ccc(cc1)/N=C/c1cccn1[Cu]
InChI Key	LYCVEUSFVISIMN-TXTNVABFSA-N
Exact Mass	890.263 g/mol

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Metadata Information

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Field	Value
DOI	10.14272/LYCVEUSFVISIMN-TXTNVABFSA-N/CHMO0001146
License URL
Source	https://www.chemotion-repository.net/inchikey/LYCVEUSFVISIMN-TXTNVABFSA-N/CHMO0001146
Version
Author	Valentina Ferraro
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:14:47.714818
MetadataModified	2024-09-23T09:22:43.731317
MetadataPublished	2024-04-17

Field	Value
Measurement Technique	1H–13C heteronuclear single quantum coherence
Measurement Variables	temperature : 298.0 K PULPROG : hsqcedetgpsisp2.3 number of scans : 8 scans title : Nov14-2023-braese date : 20231114 starting time : 23.08 h instrument : spect label : VF-182 id : 106386 Solvent : chloroform-D1 (CDCl3)