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(Q76150647)
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English
(1R,2S)-2-(2,5-dimethoxy-4-methylphenyl)cyclopropan-1-amine
chemical compound
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No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
DMCPA
0 references
mass
207.125928784
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₂H₁₇NO₂
0 references
canonical SMILES
COc1cc(C2CC2N)c(OC)cc1C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC1=CC(=C(C=C1OC)[C@@H]2C[C@H]2N)OC
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Identifiers
InChI
InChI=1S/C12H17NO2/c1-7-4-12(15-3)9(6-11(7)14-2)8-5-10(8)13/h4,6,8,10H,5,13H2,1-3H3/t8-,10+/m0/s1
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InChIKey
HYVPPECPQRBJEQ-WCBMZHEXSA-N
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CAS Registry Number
69980-34-3
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PubChem CID
3041186
1 reference
matched by identifier from
InChIKey
InChIKey
HYVPPECPQRBJEQ-WCBMZHEXSA-N
UniChem compound ID
39922
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10990120
reason for deprecated rank
applies to other chemical entity
intended subject of deprecated statement
DMCPA
0 references
DSSTOX compound identifier
DTXCID101417227
0 references
UNII
Z6D3BNP7YD
1 reference
matched by identifier from
InChIKey
InChIKey
HYVPPECPQRBJEQ-WCBMZHEXSA-N
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