Hydromorphone N-Oxide Hydrochloride (1.0mg/ml in DMSO)

Analyte Name

Hydromorphone N-Oxide Hydrochloride

Molecular Formula

C17 H19 N O4 . Cl H

Molecular Weight

337.80

Measured Value

1.0 mg/mL

Accurate Mass

337.1081

SMILES

Cl.C[N+]1([O-])CC[C@@]23[C@H]4CCC(=O)[C@@H]2Oc5c(O)ccc(C[C@@H]14)c35

InChI

InChI=1S/C17H19NO4.ClH/c1-18(21)7-6-17-10-3-5-13(20)16(17)22-15-12(19)4-2-9(14(15)17)8-11(10)18;/h2,4,10-11,16,19H,3,5-8H2,1H3;1H/t10-,11+,16-,17-,18?;/m0./s1

IUPAC

(4R,4aR,7aR,12bS)-9-hydroxy-3-methyl-3-oxido-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-3-ium-7-one;hydrochloride

Alternate CAS Number

Free base: 109648-80-8

Country of Origin

CANADA

Product Format

Single Solution

Matrix

DMSO