SpectraBase Compound ID | 3KjOJ9Ihqnt |
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InChI | InChI=1S/C18H21NO3/c20-17(14-4-2-1-3-5-14)18(21)15-6-8-16(9-7-15)19-10-12-22-13-11-19/h1-9,17-18,20-21H,10-13H2 |
InChIKey | MJZZVCJGAXHTIH-UHFFFAOYSA-N |
Mol Weight | 299.37 g/mol |
Molecular Formula | C18H21NO3 |
Exact Mass | 299.152144 g/mol |
SpectraBase Spectrum ID | 17VxukG6FrA |
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Name | Erythro/threo-1-(4-morpholinophenyl)-2-phenylethane-1,2-diol |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 299.152143537 u |
Formula | C18H21NO3 |
InChI | InChI=1S/C18H21NO3/c20-17(14-4-2-1-3-5-14)18(21)15-6-8-16(9-7-15)19-10-12-22-13-11-19/h1-9,17-18,20-21H,10-13H2 |
InChIKey | MJZZVCJGAXHTIH-UHFFFAOYSA-N |
SMILES | C=1(N2CCOCC2)C=CC(C(C(C=2C=CC=CC2)O)O)=CC1 |