Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- COCc1ccc(C#N)cc1
- InChIKey
- RUWUCOYLNIGKRD-UHFFFAOYSA-N
- 分子式
- C9H9NO
- 平均分子量
- 147.177 g/mol
- 单同位素质量
- 147.06841391
扩展信息尚未完成同步。
REACTIONS
相关反应
Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
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