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(Q82321973)
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English
3-Allyl-1H-indole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
indole alkaloid
1 reference
based on heuristic
inferred from SMILES
mass
157.089149352
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₁N
0 references
canonical SMILES
C=CCC1=CNC2=CC=CC=C21
0 references
Identifiers
InChI
InChI=1S/C11H11N/c1-2-5-9-8-12-11-7-4-3-6-10(9)11/h2-4,6-8,12H,1,5H2
0 references
InChIKey
UWJLKFQVYFDQEQ-UHFFFAOYSA-N
0 references
CAS Registry Number
16886-09-2
0 references
PubChem CID
12281271
1 reference
matched by identifier from
InChIKey
InChIKey
UWJLKFQVYFDQEQ-UHFFFAOYSA-N
UniChem compound ID
5909865
1 reference
stated in
UniChem
NMRShiftDB structure ID
20191715
1 reference
matched by identifier from
InChIKey
InChIKey
UWJLKFQVYFDQEQ-UHFFFAOYSA-N
DSSTox substance ID
DTXSID00484023
1 reference
matched by identifier from
InChIKey
InChIKey
UWJLKFQVYFDQEQ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID70434833
0 references
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