SpectraBase Compound ID | HNxvMgwyboT |
---|---|
InChI | InChI=1S/C16H13NO4/c1-8-4-5-17-15-10-6-12(20-3)13(21-9(2)18)7-11(10)16(19)14(8)15/h4-7H,1-3H3 |
InChIKey | CSDUGYQITXDYBQ-UHFFFAOYSA-N |
Mol Weight | 283.28 g/mol |
Molecular Formula | C16H13NO4 |
Exact Mass | 283.084458 g/mol |
SpectraBase Spectrum ID | GQG8IODBlB9 |
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Name | O-Acetyl-Isooncodine |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C16H13NO4 |
InChI | InChI=1S/C16H13NO4/c1-8-4-5-17-15-10-6-12(20-3)13(21-9(2)18)7-11(10)16(19)14(8)15/h4-7H,1-3H3 |
InChIKey | CSDUGYQITXDYBQ-UHFFFAOYSA-N |
Molecular Weight | 283.283 g/mol |
SMILES | C1(c2c(cc(c(c2)OC(=O)C)OC)-c2c1c(ccn2)C)=O |
SPLASH | splash10-0006-0090000000-a9af89a15544463e68fc |
Source of Spectrum | X2-53-1330-9 |
Wiley ID | 1603689 |