1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/FGXFTIBXXNBPDU-UHFFFAOYSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C78H120N4O4/c1-53(2)67(83-79-71(9,10)45-25-46-72(79,11)12)61-37-29-57(30-38-61)65(58-31-39-62(40-32-58)68(54(3)4)84-80-73(13,14)47-26-48-74(80,15)16)66(59-33-41-63(42-34-59)69(55(5)6)85-81-75(17,18)49-27-50-76(81,19)20)60-35-43-64(44-36-60)70(56(7)8)86-82-77(21,22)51-28-52-78(82,23)24/h29-44,53-56,67-70H,25-28,45-52H2,1-24H3 |
|---|---|
| SMILES | CC(C(c1ccc(cc1)/C(=C(\c1ccc(cc1)C(C(C)C)ON1C(C)(C)CCCC1(C)C)/c1ccc(cc1)C(C(C)C)ON1C(C)(C)CCCC1(C)C)/c1ccc(cc1)C(C(C)C)ON1C(C)(C)CCCC1(C)C)ON1C(C)(C)CCCC1(C)C)C |
| InChI Key | FGXFTIBXXNBPDU-UHFFFAOYSA-N |
| Molecular Formula | C78H120N4O4 |
| Exact Mass | 1177.812 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | 0812d690-c7f8-4e82-a8a7-2d7b6359277b |
| Package id | 10-14272-fgxftibxxnbpdu-uhfffaoysa-n-chmo0000593 |
| Resource type | HTML |
| State | active |