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CAS Number: 700-58-3
adamantan-2-one

Structure

 adamantan-2-one
Name: adamantan-2-one
Synonyms:
General Information
Product Number: 700583

CAS Registry Number 700-58-3
Name:
Tricyclo[3.3.1.13,?7]?decan-?2-?one
2-Adamantanone (6CI,7CI,8CI)
Tricyclo[3.3.1.13,7]decanone (9CI)
2-Adamantone
2-Oxoadamantane
Adamantanone

 

Chemical Formula: C10H14O
Exact Mass: 150.10
Molecular Weight: 150.22
m/z: 150.10 (100.0%), 151.11 (11.0%)

 

InChI:InChI=1S/C10H14O/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-9H,1-5H2

InChI Key:IYKFYARMMIESOX-UHFFFAOYSA-N

Canonical SMILES:C1C2CC3CC1CC(C2)C3=O

Specification

98%
References

(31) Netzeva, Tatiana I.; Journal of Chemical Information and Computer Sciences 2005, V45(1), P106-114 CAPLUS
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