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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

IUPAC name:
(4aR*,8aR*)-1-bromo-4a,5,9,10,11,12- hexahydro-3-methoxy-11-methyl-6H-ben zofuro[3a,3,2-ef][2]benzazepin-6-one hydrochloride

Inventory

EC number:
439-750-2
EC name:
-
CAS number:
-
Description:
T002113
CAS number:
183487-56-1
Synonyms
Names:
Identifier:
EC number
439-750-2

Molecular and structural information

Molecular formula:
Hill formula: C17H19BrClNO3
CAS formula: C17H19BrClNO3
Molecular weight:
400.7
SMILES notation:
Cl.COc1cc(Br)c2CN(C)CC[C@]34C=CC(=O)C[C@H]3Oc1c24
InChl:
InChI=1S/C17H18BrNO3.ClH/c1-19-6-5-17-4-3-10(20)7-14(17)22-16-13(21-2)8-12(18)11(9-19)15(16)17;/h3-4,8,14H,5-7,9H2,1-2H3;1H/t14-,17-;/m1./s1
Structural formula:
Chemical structure

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