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2-adamantyl 3,3-dimethylbutanoate

2-adamantyl 3,3-dimethylbutanoate

Systemtic Name:2-adamantyl 3,3-dimethylbutanoate
Openeye Name:2-adamantyl 3,3-dimethylbutanoate
CAS Name:3,3-dimethylbutanoic acid 2-adamantyl ester
IUPAC Name:2-adamantyl 3,3-dimethylbutanoate
Traditional Name:3,3-dimethylbutyric acid 2-adamantyl ester
Formula: C16H26O2
MolecularWeight: 250.37644
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1C2CC3CC(C2)CC1C3


Isomeric SMILES

CC(C)(C)CC(=O)OC1C2CC3CC(C2)CC1C3


InChI

InChI=1S/C16H26O2/c1-16(2,3)9-14(17)18-15-12-5-10-4-11(7-12)8-13(15)6-10/h10-13,15H,4-9H2,1-3H3


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