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CAS Number: 73013-51-1
ethyl 4-(2-oxopropyl)benzoate

Structure

ethyl 4-(2-oxopropyl)benzoate
Name: ethyl 4-(2-oxopropyl)benzoate
Synonyms:
General Information
Product Number: 73013511

CAS Registry Number 73013-51-1
Name:
Benzoic acid, 4-​(2-​oxopropyl)​-​, ethyl ester

 

Chemical Formula: C12H14O3
Exact Mass: 206.09
Molecular Weight: 206.24
m/z: 206.09 (100.0%), 207.10 (13.3%), 208.10 (1.4%)

 

InChI:InChI=1S/C12H14O3/c1-3-15-12(14)11-6-4-10(5-7-11)8-9(2)13/h4-7H,3,8H2,1-2H3

InChI Key:RJNSZJDYXNBUEF-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CC=C(C=C1)CC(=O)C

Specification

98%

References

(1) He, Chuan; Journal of the American Chemical Society 2010, V132(24), P8273-8275 CAPLUS

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