Analyte Name

N-Demethyl-3-methoxy-4-hydroxytamoxifen Hydrochloride (E,Z mixture)

CAS Number

2125720-13-8

Molecular Formula

C26H30ClNO3

Molecular Weight

439.97

Accurate Mass

439.1914

SMILES

OC(C(OC)=C1)=CC=C1/C(C2=CC=C(OCCNC)C=C2)=C(CC)/C3=CC=CC=C3.Cl

InChI

InChI=1S/C26H29NO3.ClH/c1-4-23(19-8-6-5-7-9-19)26(21-12-15-24(28)25(18-21)29-3)20-10-13-22(14-11-20)30-17-16-27-2;/h5-15,18,27-28H,4,16-17H2,1-3H3;1H/b26-23+;

IUPAC

2-methoxy-4-[(E)-1-[4-[2-(methylamino)ethoxy]phenyl]-2-phenylbut-1-enyl]phenol;hydrochloride

Alternate CAS Number

Free base: 2125720-12-7

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat