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(Q115948153)
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English
Einecs 230-969-7
group of stereoisomers with the chemical formula C₁₄H₂₂O
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
206.167065324
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₂₂O
0 references
canonical SMILES
O=C(C(=CC1C(=C)CCCC1(C)C)C)C
0 references
isomeric SMILES
C=C1CCCC(C)(C)C1/C=C(\C)C(C)=O
1 reference
based on heuristic
inferred from InChI
found in taxon
Murraya paniculata
1 reference
stated in
Essential oil composition ofMurraya exotica from the plains of northern India
Identifiers
InChI
InChI=1S/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h9,13H,1,6-8H2,2-5H3/b11-9+
0 references
InChIKey
YQUFLLFXOARBNW-PKNBQFBNSA-N
0 references
PubChem CID
6437590
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQUFLLFXOARBNW-PKNBQFBNSA-N
SureChEMBL ID
SCHEMBL1202969
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQUFLLFXOARBNW-PKNBQFBNSA-N
SCHEMBL1202967
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQUFLLFXOARBNW-PKNBQFBNSA-N
UniChem compound ID
68227855
1 reference
stated in
UniChem
KNApSAcK ID
C00062846
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YQUFLLFXOARBNW-PKNBQFBNSA-N
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