Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
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IDENTITY
结构与身份
- 标准SMILES
- CC(C)(C)COC(=O)CC#N
- InChIKey
- MKXONZIDTWQRSO-UHFFFAOYSA-N
- 分子式
- C8H13NO2
- 平均分子量
- 155.197 g/mol
- 单同位素质量
- 155.09462866
扩展信息尚未完成同步。
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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uspto-grants-1994_03 · 10.6084/m9.figshare.5104873.v1 · US05290838
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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
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uspto-grants-1990_10 · 10.6084/m9.figshare.5104873.v1 · US04963590
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uspto-grants-1992_05 · 10.6084/m9.figshare.5104873.v1 · US05112861
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uspto-grants-1992_12 · 10.6084/m9.figshare.5104873.v1 · US05175337
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uspto-grants-1995_08 · 10.6084/m9.figshare.5104873.v1 · US05446194
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