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(Q102349611)
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English
dehydromaprotiline
pair of cis-trans isomers
(E/Z)-dehydromaprotiline
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
275.3882
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₁N
0 references
canonical SMILES
CNCC=CC12CCC(C3=CC=CC=C31)C4=CC=CC=C24
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Identifiers
InChI
InChI=1S/C20H21N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-10,12,15,21H,11,13-14H2,1H3
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InChIKey
AVGBUXKOOSTZQV-UHFFFAOYSA-N
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CAS Registry Number
38982-14-8
1 reference
InChIKey
AVGBUXKOOSTZQV-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=38982-14-8
PubChem CID
131878804
0 references
UniChem compound ID
163961474
1 reference
stated in
UniChem
UNII
1KTM9PL1TD
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