| SpectraBase Compound ID | KV4uQRLkdYh |
|---|---|
| InChI | InChI=1S/C33H45NO7/c1-5-34-17-31(18-38-2)14-13-23(35)33-21-15-20-22(39-3)16-32(37,26(30(33)34)28(40-4)29(31)33)25(21)27(20)41-24(36)12-11-19-9-7-6-8-10-19/h6-12,20-23,25-30,35,37H,5,13-18H2,1-4H3/b12-11+/t20-,21-,22+,23+,25-,26+,27+,28+,29-,30?,31+,32-,33+/m1/s1 |
| InChIKey | QNCJLCAJHJQEGR-YNEABFONSA-N |
| Mol Weight | 567.7 g/mol |
| Molecular Formula | C33H45NO7 |
| Exact Mass | 567.319603 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BkQg79dDAe1 |
|---|---|
| Name | 14-O-CINNAMOYLNEOLINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H45NO7 |
| InChI | InChI=1S/C33H45NO7/c1-5-34-17-31(18-38-2)14-13-23(35)33-21-15-20-22(39-3)16-32(37,26(30(33)34)28(40-4)29(31)33)25(21)27(20)41-24(36)12-11-19-9-7-6-8-10-19/h6-12,20-23,25-30,35,37H,5,13-18H2,1-4H3/b12-11+/t20-,21-,22+,23+,25-,26+,27+,28+,29-,30?,31+,32-,33+/m1/s1 |
| InChIKey | QNCJLCAJHJQEGR-YNEABFONSA-N |
| Literature Reference Author | S.H.SHIM,J.S.KIM,S.S.KANG |
| Literature Reference Citation | CHEM.PHARM.BULL.,51,999(2003) |
| Literature Reference DOI | 10.1248/cpb.51.999 |
| Molecular Weight | 567.723 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU20244 |