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methyl 7-methyloctanoate

methyl 7-methyloctanoate

Systemtic Name:methyl 7-methyloctanoate
Openeye Name:methyl 7-methyloctanoate
CAS Name:7-methyloctanoic acid methyl ester
IUPAC Name:methyl 7-methyloctanoate
Traditional Name:7-methylcaprylic acid methyl ester
Formula: C10H20O2
MolecularWeight: 172.2646
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(=O)OC


Isomeric SMILES

CC(C)CCCCCC(=O)OC


InChI

InChI=1S/C10H20O2/c1-9(2)7-5-4-6-8-10(11)12-3/h9H,4-8H2,1-3H3


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