| CAS Number: 1273587-21-5 ethyl 2-(4-cyanophenyl)-2-methylpropanoate |
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| General Information | ||||||
| Product Number: 1273587215
CAS Registry Number: 1273587-21-5
Name:
Benzeneacetic acid, 4-cyano-α,α-dimethyl-, ethyl ester
Ethyl 2-(4-cyanophenyl)-2-methylpropanoate
Chemical Formula: C13H15NO2
Exact Mass: 217.11
Molecular Weight: 217.26
m/z: 217.11 (100.0%), 218.11 (14.5%)
Elemental Analysis: C, 71.87; H, 6.96; N, 6.45; O, 14.73
InChI: InChI=1S/C14H17N5OS/c1-9-7-10(2)19(18-9)12-5-6-14(17-16-12)21-8-13(20)15-11-3-4-11/h5-7,11H,3-4,8H2,1-2H3,(H,15,20)
InChIKey: SQNDSTGHLJKOSZ-UHFFFAOYSA-N
Canonical SMILES : CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)NC3CC3)C
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Specification |
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98% |
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