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Metoprolol n-butylboronate

View entire compound with spectra: 4 MS (GC)

Metoprolol n-butylboronate
SpectraBase Compound ID LUezPNVqFf3
InChI InChI=1S/C19H32BNO3/c1-5-6-12-20-21(16(2)3)14-19(24-20)15-23-18-9-7-17(8-10-18)11-13-22-4/h7-10,16,19H,5-6,11-15H2,1-4H3
InChIKey LNVPQPWUPVFLHS-UHFFFAOYSA-N
Mol Weight 333.3 g/mol
Molecular Formula C19H32BNO3
Exact Mass 333.247524 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0tMLKAkPAS
Name Metoprolol n-butylboronate
Alternate Name(s) 2-Butyl-5-[[4-(2-methoxyethyl)phenoxy]methyl]-3-propan-2-yl-1,3,2-oxazaborolidine
CAS Registry Number 127215-09-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32BNO3
InChI InChI=1S/C19H32BNO3/c1-5-6-12-20-21(16(2)3)14-19(24-20)15-23-18-9-7-17(8-10-18)11-13-22-4/h7-10,16,19H,5-6,11-15H2,1-4H3
InChIKey LNVPQPWUPVFLHS-UHFFFAOYSA-N
Molecular Weight 333.279 g/mol
SMILES C1N(B(OC1COc1ccc(cc1)CCOC)CCCC)C(C)C
SPLASH splash10-014i-0009000000-ef89d42b0150acbf1d04
Source of Spectrum JC-488-364-0
Wiley ID 1330319