| SpectraBase Compound ID | HcmJfXrRpXb |
|---|---|
| InChI | InChI=1S/C20H25NO5/c1-21(23)8-7-14-11-17(22)19(25-3)12-15(14)16(21)9-13-5-6-18(24-2)20(10-13)26-4/h5-6,10-12,16,22H,7-9H2,1-4H3 |
| InChIKey | OONHTOHPWNGGFY-UHFFFAOYSA-N |
| Mol Weight | 359.42 g/mol |
| Molecular Formula | C20H25NO5 |
| Exact Mass | 359.173273 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | C3eiYv9DT8g |
|---|---|
| Name | (cis)-N-oxy-Pseudolaudanine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.173272904 u |
| Formula | C20H25NO5 |
| InChI | InChI=1S/C20H25NO5/c1-21(23)8-7-14-11-17(22)19(25-3)12-15(14)16(21)9-13-5-6-18(24-2)20(10-13)26-4/h5-6,10-12,16,22H,7-9H2,1-4H3 |
| InChIKey | OONHTOHPWNGGFY-UHFFFAOYSA-N |
| Molecular Weight | 359.422 g/mol |
| SMILES | C1([N+](CCC2=CC(=C(C=C12)OC)O)([O-])C)CC1=CC(OC)=C(C=C1)OC |