Product Name METHYLTRANS-3-OXO-2-PENTYLCYCLOPENTANEACETATE
CAS
MFC13H22O3
MW226.31198
InChIInChI=1/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h10-11H,3-9H2,1-2H3/t10-,11-/s3
InChIKeyKVWWIYGFBYDJQC-ZOMVLEFPNA-N
Smiles[C@@H]1(CC(OC)=O)CCC(=O)[C@H]1CCCCC |&1:0,10,r|
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Assign. Shift(ppm) A 3.705 B 2.632 C 2.34 D 2.24 E *1 2.15 F *1 2.13 G *2 1.802 J 1.54 K *2 1.48 L *3 1.41 M *3 1.29 to 1.26 N 0.877
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