![2-[4-Oxo-4-(4-phenylazo-phenyl)-butyrylamino]-3-(3,7,11-trimethyl-dodeca-2,6,10-trienylsulfanyl)-propionic acid](/api/spectrum/3ektMzlQLU0/structure.png?h=300&w=458 "2-[4-Oxo-4-(4-phenylazo-phenyl)-butyrylamino]-3-(3,7,11-trimethyl-dodeca-2,6,10-trienylsulfanyl)-propionic acid")
| SpectraBase Compound ID | HWKGgz3IcUL |
|---|---|
| InChI | InChI=1S/C34H43N3O4S/c1-25(2)10-8-11-26(3)12-9-13-27(4)22-23-42-24-31(34(40)41)35-33(39)21-20-32(38)28-16-18-30(19-17-28)37-36-29-14-6-5-7-15-29/h5-7,10,12,14-19,22,31H,8-9,11,13,20-21,23-24H2,1-4H3,(H,35,39)(H,40,41)/b26-12+,27-22+,37-36+ |
| InChIKey | KHEBCGGBLVZUIV-XJSGGQSZSA-N |
| Mol Weight | 589.8 g/mol |
| Molecular Formula | C34H43N3O4S |
| Exact Mass | 589.297428 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 3ektMzlQLU0 |
|---|---|
| Name | 2-[4-Oxo-4-(4-phenylazo-phenyl)-butyrylamino]-3-(3,7,11-trimethyl-dodeca-2,6,10-trienylsulfanyl)-propionic acid |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C34H43N3O4S |
| InChI | InChI=1S/C34H43N3O4S/c1-25(2)10-8-11-26(3)12-9-13-27(4)22-23-42-24-31(34(40)41)35-33(39)21-20-32(38)28-16-18-30(19-17-28)37-36-29-14-6-5-7-15-29/h5-7,10,12,14-19,22,31H,8-9,11,13,20-21,23-24H2,1-4H3,(H,35,39)(H,40,41)/b26-12+,27-22+,37-36+ |
| InChIKey | KHEBCGGBLVZUIV-XJSGGQSZSA-N |
| Instrument Name | Bruker WM-250 |
| NMR Standard | DMSO-D6 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |