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6976-72-3 molecular structure
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heptyl hexanoate

ChemBase ID: 110321
Molecular Formular: C13H26O2
Molecular Mass: 214.34434
Monoisotopic Mass: 214.19328007
SMILES and InChIs

SMILES:
CCCCCCCOC(=O)CCCCC
Canonical SMILES:
CCCCCCCOC(=O)CCCCC
InChI:
InChI=1S/C13H26O2/c1-3-5-7-8-10-12-15-13(14)11-9-6-4-2/h3-12H2,1-2H3
InChIKey:
QEKCBKVWQYEUGY-UHFFFAOYSA-N

Cite this record

CBID:110321 http://www.chembase.cn/molecule-110321.html

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