SpectraBase Compound ID | IfJYJYkPFpB |
---|---|
InChI | InChI=1S/C23H30N2O3/c1-24-18-7-5-4-6-15(18)16-10-11-25-13-14-8-9-20(27-2)21(23(26)28-3)17(14)12-19(25)22(16)24/h4-7,14,17,19-21H,8-13H2,1-3H3/t14-,17-,19-,20-,21-/m0/s1 |
InChIKey | OQMJBLOXUWCDAQ-NUCDUYEVSA-N |
Mol Weight | 382.5 g/mol |
Molecular Formula | C23H30N2O3 |
Exact Mass | 382.225643 g/mol |
SpectraBase Spectrum ID | GOXFrjvSVEu |
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Name | Rauhimbin, N,o-dimethyl- |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 382.225642831 u |
Formula | C23H30N2O3 |
InChI | InChI=1S/C23H30N2O3/c1-24-18-7-5-4-6-15(18)16-10-11-25-13-14-8-9-20(27-2)21(23(26)28-3)17(14)12-19(25)22(16)24/h4-7,14,17,19-21H,8-13H2,1-3H3/t14-,17-,19-,20-,21-/m0/s1 |
InChIKey | OQMJBLOXUWCDAQ-NUCDUYEVSA-N |
Molecular Weight | 382.504 g/mol |
SMILES | C12=C(C3=CC=CC=C3N2C)CCN2[C@]1(C[C@@]1([C@](C(=O)OC)([C@](CC[C@@]1([H])C2)(OC)[H])[H])[H])[H] |