Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
InChI | InChI=1S/C28H24F2N3.HI/c1-33-15-13-22(14-16-33)24-17-19-5-9-21(24)10-6-20-8-12-23(11-7-19)27(18-20)31-32-28-25(29)3-2-4-26(28)30;/h2-5,8-9,12-18H,6-7,10-11H2,1H3;1H/q+1;/p-1/b32-31+; |
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SMILES | C[n+]1ccc(cc1)c1cc2CCc3ccc(CCc1cc2)cc3/N=N/c1c(F)cccc1F.[I-] |
InChI Key | JDTNNFQGVPIDIT-MRRLHAJBSA-M |
Molecular Formula | C28H24F2IN3 |
Exact Mass | 567.412 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/JDTNNFQGVPIDIT-MRRLHAJBSA-M/CHMO0001146 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/JDTNNFQGVPIDIT-MRRLHAJBSA-M/CHMO0001146 |
Version | |
Author | Yichuan Wang |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T04:05:21.021248 |
MetadataModified | 2024-09-08T04:05:21.021253 |
MetadataPublished | 2024-07-10 |
Field | Value |
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Measurement Technique | 1H–13C heteronuclear single quantum coherence |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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No additional information available for this Dataset. |