![L-Phenylalanine, N-[(3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]-, (R)-](/api/spectrum/E5NFZt9ASIO/structure.png?h=300&w=458 "L-Phenylalanine, N-[(3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]-, (R)-")
| SpectraBase Compound ID | 45hBMhx6pp8 |
|---|---|
| InChI | InChI=1S/C20H19NO6/c1-11-9-13-7-8-14(17(22)16(13)20(26)27-11)18(23)21-15(19(24)25)10-12-5-3-2-4-6-12/h2-8,11,15,22H,9-10H2,1H3,(H,21,23)(H,24,25) |
| InChIKey | DAEYIVCTQUFNTM-UHFFFAOYSA-N |
| Mol Weight | 369.37 g/mol |
| Molecular Formula | C20H19NO6 |
| Exact Mass | 369.121237 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5NFZt9ASIO |
|---|---|
| Name | Ochratoxin B |
| CAS Registry Number | 4825-86-9 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H19NO6 |
| InChI | InChI=1S/C20H19NO6/c1-11-9-13-7-8-14(17(22)16(13)20(26)27-11)18(23)21-15(19(24)25)10-12-5-3-2-4-6-12/h2-8,11,15,22H,9-10H2,1H3,(H,21,23)(H,24,25) |
| InChIKey | DAEYIVCTQUFNTM-UHFFFAOYSA-N |
| Instrument Name | Finnigan 4021 |
| Literature Reference | M.W. Bredenkamp, J.L. Dillen, J. Chem. Soc. Perkin II 1835 (1989). |
| NMR Standard | DMSO-D6 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |