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Reference substances

Reference substances

IUPAC name:
1-{4-[2-(dimethylamino)ethoxy]phenyl}-1,2-diphenylbutan-1-ol

Inventory

EC number:
278-718-0
EC name:
(R*,S*)-(±)-α-[4-[2-(dimethylamino)ethoxy]phenyl]-β-ethyl-α-phenylphenethyl alcohol
CAS number:
77542-06-4
CAS number:
77542-06-4
Synonyms
Names:
rel-(1S,2R)-1-{4-[2-(dimethylamino)ethoxy]phenyl}-1,2-diphenylbutan-1-ol

Molecular and structural information

Molecular formula:
C26H31NO2
Molecular weight:
ca. 389.53
SMILES notation:
CC[C@@H](c1ccccc1)[C@@](O)(c1ccccc1)c1ccc(OCCN(C)C)cc1.CC[C@H](c1ccccc1)[C@@](O)(c1ccc(OCCN(C)C)cc1)c1ccccc1
InChl:
InChI=1S/2C26H31NO2/c2*1-4-25(21-11-7-5-8-12-21)26(28,22-13-9-6-10-14-22)23-15-17-24(18-16-23)29-20-19-27(2)3/h2*5-18,25,28H,4,19-20H2,1-3H3/t2*25-,26+/m10/s1
Structural formula:
Chemical structure

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