heteronuclear multiple bond coherence (HMBC)
URL: https://www.chemotion-repository.net/inchikey/DMRAVMAMSLYEBQ-UHFFFAOYSA-N/CHMO0000601
Dataset description:
dataset for heteronuclear multiple bond coherence (HMBC)\n\n
Chemical Info
InChI | InChI=1S/C22H18N6O2/c1-15-3-5-16(6-4-15)12-27-13-19(11-23)21(25-27)28-14-20(24-26-28)17-7-9-18(10-8-17)22(29)30-2/h3-10,13-14H,12H2,1-2H3 |
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SMILES | COC(=O)c1ccc(cc1)c1nnn(c1)c1nn(cc1C#N)Cc1ccc(cc1)C |
InChI Key | DMRAVMAMSLYEBQ-UHFFFAOYSA-N |
Molecular Formula | C22H18N6O2 |
Exact Mass | 398.417 g/mol |
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Additional Information
Field | Value |
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Data last updated | September 8, 2024 |
Metadata last updated | September 8, 2024 |
Created | September 8, 2024 |
Format | HTML |
License | No License Provided |
Id | afadbb07-2c7d-4f0e-b4a6-517fc531dd4b |
Package id | 10-14272-dmravmamslyebq-uhfffaoysa-n-chmo0000601 |
Resource type | HTML |
State | active |