Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
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结构与身份
- 标准SMILES
- COc1cc(C(=O)OC(C)(C)C)ccc1C
- InChIKey
- XTRDRJZXPPUNAN-UHFFFAOYSA-N
- 分子式
- C13H18O3
- 平均分子量
- 222.284 g/mol
- 单同位素质量
- 222.12559444
扩展信息尚未完成同步。
REACTIONS
IDENTITY
REACTIONS
Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D
查看uspto-grants-1990_01 · 10.6084/m9.figshare.5104873.v1 · US04894386
查看uspto-grants-1990_01 · 10.6084/m9.figshare.5104873.v1 · US04894386
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