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6-methylheptyl 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate

6-methylheptyl 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate

Systemtic Name:6-methylheptyl 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate
Openeye Name:6-methylheptyl 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate
CAS Name:2-mercapto-8-methyl-2-(6-methylheptyl)nonanoic acid 6-methylheptyl ester
IUPAC Name:6-methylheptyl 8-methyl-2-(6-methylheptyl)-2-sulfanylnonanoate
Traditional Name:2-mercapto-8-methyl-2-(6-methylheptyl)pelargonic acid 6-methylheptyl ester
Formula: C26H52O2S
MolecularWeight: 428.75488
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(CCCCCC(C)C)(C(=O)OCCCCCC(C)C)S


Isomeric SMILES

CC(C)CCCCCC(CCCCCC(C)C)(C(=O)OCCCCCC(C)C)S


InChI

InChI=1S/C26H52O2S/c1-22(2)16-10-7-13-19-26(29,20-14-8-11-17-23(3)4)25(27)28-21-15-9-12-18-24(5)6/h22-24,29H,7-21H2,1-6H3


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