SpectraBase Compound ID | 397iTLS9rPx |
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InChI | InChI=1S/C18H17NO3/c1-21-15-9-11-7-8-19-17(14(11)10-16(15)22-2)12-5-3-4-6-13(12)18(19)20/h3-6,9-10,17H,7-8H2,1-2H3 |
InChIKey | MMHYYMDNTIDRIJ-UHFFFAOYSA-N |
Mol Weight | 295.34 g/mol |
Molecular Formula | C18H17NO3 |
Exact Mass | 295.120843 g/mol |
SpectraBase Spectrum ID | 9jl1qYIY8U2 |
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Name | 2,3-Dimethoxy-5,12B-dihydroisoindolo[1,2-A]isoquinolin-8(6H)-one |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 295.120843408 u |
Formula | C18H17NO3 |
InChI | InChI=1S/C18H17NO3/c1-21-15-9-11-7-8-19-17(14(11)10-16(15)22-2)12-5-3-4-6-13(12)18(19)20/h3-6,9-10,17H,7-8H2,1-2H3 |
InChIKey | MMHYYMDNTIDRIJ-UHFFFAOYSA-N |
SMILES | C12N(CCC=3C=C(C(=CC23)OC)OC)C(C=2C=CC=CC12)=O |