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(Q82916300)
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English
(4,8,8-Trimethyldecahydro-1,4-methanoazulen-9-yl)methyl acetate
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
264.208930136
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₈O₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=O)OCC1C2CCC3C2C(C)(C)CCCC13C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(=O)OCC1[C@H]2CC[C@@H]3[C@H]2C(C)(C)CCC[C@]13C
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H28O2/c1-11(18)19-10-14-12-6-7-13-15(12)16(2,3)8-5-9-17(13,14)4/h12-15H,5-10H2,1-4H3/t12-,13-,14?,15+,17+/m1/s1
0 references
InChIKey
FWCPQBUXTSVEIC-KXBASQGXSA-N
0 references
CAS Registry Number
18367-70-9
0 references
PubChem CID
87600
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
42793294
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00939740
0 references
DSSTOX compound identifier
DTXCID501368230
0 references
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