1H--13C heteronuclear multiple bond coherence...
URL: https://www.chemotion-repository.net/inchikey/PXXDVSMLHGSDBP-UHFFFAOYSA-N/CHMO0001148
Dataset description:
dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)\n\n
Source: 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
InChI | InChI=1S/C29H14F17NO/c30-16-9-5-14(6-10-16)13-47-19-4-2-1-3-18(19)20(21(47)15-7-11-17(31)12-8-15)22(48)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)28(42,43)29(44,45)46/h1-12H,13H2 |
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SMILES | Fc1ccc(cc1)c1c(c2c(n1Cc1ccc(cc1)F)cccc2)C(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
InChI Key | PXXDVSMLHGSDBP-UHFFFAOYSA-N |
Molecular Formula | C29H14F17NO |
Exact Mass | 715.400 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 | 70dafcd0-e632-4e83-8568-5a80116681b5 |
Package id | 10-14272-pxxdvsmlhgsdbp-uhfffaoysa-n-chmo0001148 |
Resource type | HTML |
State | active |