| SpectraBase Compound ID | ARpEhecbCIR |
|---|---|
| InChI | InChI=1S/C22H33NO3/c1-13-14-4-7-22(18(13)25)16(10-14)21-6-3-5-20(2,15(21)11-17(22)24)19-23(12-21)8-9-26-19/h14-19,24-25H,1,3-12H2,2H3/t14?,15?,16?,17?,18?,19?,20-,21+,22?/m1/s1 |
| InChIKey | NECCSQDLMQIKJF-POSGMWHBSA-N |
| Mol Weight | 359.5 g/mol |
| Molecular Formula | C22H33NO3 |
| Exact Mass | 359.246044 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E1BL4ER2mHw |
|---|---|
| Name | 7-alpha-HYDROXY-ISOATISINE |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C22H33NO3/c1-13-14-4-7-22(18(13)25)16(10-14)21-6-3-5-20(2,15(21)11-17(22)24)19-23(12-21)8-9-26-19/h14-19,24-25H,1,3-12H2,2H3/t14?,15?,16?,17?,18?,19?,20-,21+,22?/m1/s1 |
| InChIKey | NECCSQDLMQIKJF-POSGMWHBSA-N |
| Literature Reference | S.W.PELLETIER,N.V.MODY J.AM.CHEM.SOC.,101,492(1979) |
| Solvent | Chloroform-d |