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(Q76415783)
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English
(2R,5S)-2,5-dimethyl-1-prop-2-enylpiperazine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
154.146998576
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(+)-(2S,5R)-1-Allyl-2,5-dimethylpiperazine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₉H₁₈N₂
0 references
canonical SMILES
C=CCN1CC(C)NCC1C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@H]1CN[C@H](CN1CC=C)C
0 references
Identifiers
InChI
InChI=1S/C9H18N2/c1-4-5-11-7-8(2)10-6-9(11)3/h4,8-10H,1,5-7H2,2-3H3/t8-,9+/m0/s1
0 references
InChIKey
VKUXNUOPPQWDMV-DTWKUNHWSA-N
0 references
CAS Registry Number
155836-78-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
10534891
1 reference
matched by identifier from
InChIKey
InChIKey
VKUXNUOPPQWDMV-DTWKUNHWSA-N
SureChEMBL ID
SCHEMBL231228
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VKUXNUOPPQWDMV-DTWKUNHWSA-N
UniChem compound ID
24811159
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID401235781
1 reference
matched by identifier from
InChIKey
InChIKey
VKUXNUOPPQWDMV-DTWKUNHWSA-N
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