| CAS Number: 50458-79-2 ethyl isoquinoline-3-carboxylate |
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| General Information | ||||||
| Product Number: 50458792
CAS Registry Number: 50458-79-2
Name:
3-Isoquinolinecarboxylic acid, ethyl ester
Ethyl 3-isoquinolinecarboxylate
Chemical Formula: C12H11NO2
Exact Mass: 201.08
Molecular Weight: 201.22
m/z: 201.08 (100.0%), 202.08 (13.4%)
Elemental Analysis: C, 71.63; H, 5.51; N, 6.96; O, 15.90
InChI: InChI=1S/C12H11NO2/c1-2-15-12(14)11-7-9-5-3-4-6-10(9)8-13-11/h3-8H,2H2,1H3
InChIKey: IFSCYCNNAIADLI-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CC2=CC=CC=C2C=N1
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Specification |
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98% |
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