| SpectraBase Compound ID | A1LzjTIttuZ |
|---|---|
| InChI | InChI=1S/C32H52O7/c1-8-31(9-2)38-26(12-13-27(3,4)36)30(7,39-31)25-11-15-32(37)20-16-22(33)21-17-23(34)24(35)18-28(21,5)19(20)10-14-29(25,32)6/h16,19,21,23-26,34-37H,8-15,17-18H2,1-7H3/t19-,21-,23+,24-,25-,26+,28+,29+,30+,32+/m0/s1 |
| InChIKey | QVQHCGCYNDBWQD-OUSFXLJKSA-N |
| Mol Weight | 548.8 g/mol |
| Molecular Formula | C32H52O7 |
| Exact Mass | 548.371304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I8p8dDgV3mD |
|---|---|
| Name | QVQHCGCYNDBWQD-OUSFXLJKSA-N |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H52O7 |
| InChI | InChI=1S/C32H52O7/c1-8-31(9-2)38-26(12-13-27(3,4)36)30(7,39-31)25-11-15-32(37)20-16-22(33)21-17-23(34)24(35)18-28(21,5)19(20)10-14-29(25,32)6/h16,19,21,23-26,34-37H,8-15,17-18H2,1-7H3/t19-,21-,23+,24-,25-,26+,28+,29+,30+,32+/m0/s1 |
| InChIKey | QVQHCGCYNDBWQD-OUSFXLJKSA-N |
| Literature Reference Author | A.BALAZS,A.HUNYADI,J.CSABI,N.JEDLINSZKI,A.MARTINS,A.SIMON,G. TOTH |
| Literature Reference Citation | MAGN.RES.CHEM.,51,830(2013) |
| Literature Reference DOI | 10.1002/mrc.4015 |
| Molecular Weight | 548.761 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWIR13282 |