1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/ULZNCKZFBIKUQU-KIHHCIJBSA-N/NMR/1H/CDCl3/400
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
InChI | InChI=1S/C27H25NO5/c29-26(33-20-11-5-2-6-12-20)21-13-7-14-23-22(21)17-24(25-15-8-16-31-25)28(23)27(30)32-18-19-9-3-1-4-10-19/h1-12,14-16,21-24H,13,17-18H2/t21-,22+,23-,24-/m0/s1 |
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SMILES | O=C(N1[C@H]2C=CC[C@@H]([C@H]2C[C@H]1c1ccco1)C(=O)Oc1ccccc1)OCc1ccccc1 |
InChI Key | ULZNCKZFBIKUQU-KIHHCIJBSA-N |
Molecular Formula | C27H25NO5 |
Exact Mass | 443.491 g/mol |
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Additional Information
Field | Value |
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Data last updated | September 7, 2024 |
Metadata last updated | September 7, 2024 |
Created | September 7, 2024 |
Format | HTML |
License | No License Provided |
Id | 3decbb1b-6477-492c-a9b9-42207719aea9 |
Package id | 10-14272-ulznckzfbikuqu-kihhcijbsa-n-nmr-1h-cdcl3-400 |
Resource type | HTML |
State | active |