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Atenolol n-butylboronate
SpectraBase Compound ID 98NxNZZbZvC
InChI InChI=1S/C18H29BN2O3/c1-4-5-10-19-21(14(2)3)12-17(24-19)13-23-16-8-6-15(7-9-16)11-18(20)22/h6-9,14,17H,4-5,10-13H2,1-3H3,(H2,20,22)
InChIKey DCAZCPGJKMQVIK-UHFFFAOYSA-N
Mol Weight 332.3 g/mol
Molecular Formula C18H29BN2O3
Exact Mass 332.227123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JcKO9hP2bgI
Name 2-(4-((2-butyl-3-isopropyl-1,3,2-oxazaborolidin-5-yl)methoxy)phenyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29BN2O3
InChI InChI=1S/C18H29BN2O3/c1-4-5-10-19-21(14(2)3)12-17(24-19)13-23-16-8-6-15(7-9-16)11-18(20)22/h6-9,14,17H,4-5,10-13H2,1-3H3,(H2,20,22)
InChIKey DCAZCPGJKMQVIK-UHFFFAOYSA-N
Instrument Name Hewlett-Packard-5890A-5970B
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19980915)12_17_1150
Molecular Weight 332.251 g/mol
SMILES NC(Cc1ccc(cc1)OCC1OB(N(C1)C(C)C)CCCC)=O
SPLASH splash10-014i-5907000000-0cc4a7eed391b7dcc89f
Source of Spectrum RCM-12-1156-Atenolol-BBA
Wiley ID 1837749