| SpectraBase Compound ID | gKfao69v0M |
|---|---|
| InChI | InChI=1S/C41H50BrNO18/c1-19-30(54-22(4)45)33(55-23(5)46)35(56-24(6)47)40(52-19)61-34-31(58-37(49)25-14-10-8-11-15-25)20(2)53-41(36(34)59-38(50)26-16-12-9-13-17-26)60-32-28(43-21(3)44)39(51-7)57-27(18-42)29(32)48/h8-17,19-20,27-36,39-41,48H,18H2,1-7H3,(H,43,44)/t19-,20-,27+,28+,29+,30-,31-,32+,33+,34+,35+,36+,39+,40-,41-/m0/s1 |
| InChIKey | FIVQKWAFMZZQQO-UHLPRIENSA-N |
| Mol Weight | 924.7 g/mol |
| Molecular Formula | C41H50BrNO18 |
| Exact Mass | 923.221127 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CRP7sg4uT3J |
|---|---|
| Name | FIVQKWAFMZZQQO-UHLPRIENSA-N |
| Compound Number | 44 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H50BrNO18 |
| InChI | InChI=1S/C41H50BrNO18/c1-19-30(54-22(4)45)33(55-23(5)46)35(56-24(6)47)40(52-19)61-34-31(58-37(49)25-14-10-8-11-15-25)20(2)53-41(36(34)59-38(50)26-16-12-9-13-17-26)60-32-28(43-21(3)44)39(51-7)57-27(18-42)29(32)48/h8-17,19-20,27-36,39-41,48H,18H2,1-7H3,(H,43,44)/t19-,20-,27+,28+,29+,30-,31-,32+,33+,34+,35+,36+,39+,40-,41-/m0/s1 |
| InChIKey | FIVQKWAFMZZQQO-UHLPRIENSA-N |
| Literature Reference Author | F.I.AZANNEAU,D.R.BUNDLE |
| Literature Reference Citation | CAN.J.CHEM.,71,534(1993) |
| Literature Reference DOI | 10.1139/v93-076 |
| Molecular Weight | 924.748 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP3559 |