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Metipranolol
SpectraBase Compound ID 7sxDL2hpqWa
InChI InChI=1S/C17H27NO4/c1-10(2)18-8-15(20)9-21-16-7-11(3)17(22-14(6)19)13(5)12(16)4/h7,10,15,18,20H,8-9H2,1-6H3
InChIKey BQIPXWYNLPYNHW-UHFFFAOYSA-N
Mol Weight 309.41 g/mol
Molecular Formula C17H27NO4
Exact Mass 309.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOjPmvMrqYh
Name metipranolol
Alternate Name(s) Acetic acid [4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3,6-trimethylphenyl] ester [4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3,6-trimethylphenyl] acetate [4-[2-hydroxy-3-(isopropylamino)propoxy]-2,3,6-trimethyl-phenyl] acetate [2,3,6-trimethyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl] ethanoate
Comments Note: The molecular formula of the structure shown is C17H27NO4 - which differs from the formula reported for the mass spectrum (C19H31NO3)
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Formula C19H31NO3
InChI InChI=1S/C17H27NO4/c1-10(2)18-8-15(20)9-21-16-7-11(3)17(22-14(6)19)13(5)12(16)4/h7,10,15,18,20H,8-9H2,1-6H3
InChIKey BQIPXWYNLPYNHW-UHFFFAOYSA-N
Molecular Weight 309.406 g/mol
SMILES N(CC(COc1c(c(c(c(c1)C)OC(=O)C)C)C)O)C(C)C
SPLASH splash10-03fr-2900000000-f8158b759521757e6a21
Source of Spectrum CJ-1992-0-0
Wiley ID 1321025