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(Q104981920)
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English
(2S)-undecan-2-yl (2R)-2-methylbutanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
undecan-2-yl 2-methylbutanoate
1 reference
based on heuristic
inferred from SMILES
mass
256.240230264
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₃₂O₂
0 references
canonical SMILES
O=C(OC(C)CCCCCCCCC)C(C)CC
0 references
isomeric SMILES
CCCCCCCCC[C@H](C)OC(=O)[C@H](C)CC
0 references
found in taxon
Ruta graveolens
1 reference
stated in
DAS ÄTHERISCHE ÖL DER CALLUSKULTUREN VONRUTA GRAVEOLENS
Identifiers
InChI
InChI=1S/C16H32O2/c1-5-7-8-9-10-11-12-13-15(4)18-16(17)14(3)6-2/h14-15H,5-13H2,1-4H3/t14-,15+/m1/s1
0 references
InChIKey
DJBPWDZTKRFDAO-CABCVRRESA-N
0 references
PubChem CID
163187701
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DJBPWDZTKRFDAO-CABCVRRESA-N
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