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2-butyl-5-((4-((2-isopropoxyethoxy)methyl)phenoxy)methyl)-3-isopropyl-1,3,2-oxazaborolidine
SpectraBase Compound ID KHRiOXTxP8w
InChI InChI=1S/C22H38BNO4/c1-6-7-12-23-24(18(2)3)15-22(28-23)17-27-21-10-8-20(9-11-21)16-25-13-14-26-19(4)5/h8-11,18-19,22H,6-7,12-17H2,1-5H3
InChIKey QSKJUUCNUNIBQW-UHFFFAOYSA-N
Mol Weight 391.4 g/mol
Molecular Formula C22H38BNO4
Exact Mass 391.289389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7k7kWH9veyY
Name 2-butyl-5-((4-((2-isopropoxyethoxy)methyl)phenoxy)methyl)-3-isopropyl-1,3,2-oxazaborolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38BNO4
InChI InChI=1S/C22H38BNO4/c1-6-7-12-23-24(18(2)3)15-22(28-23)17-27-21-10-8-20(9-11-21)16-25-13-14-26-19(4)5/h8-11,18-19,22H,6-7,12-17H2,1-5H3
InChIKey QSKJUUCNUNIBQW-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 391.359 g/mol
SMILES c1(ccc(cc1)OCC1CN(B(O1)CCCC)C(C)C)COCCOC(C)C
SPLASH splash10-05x3-6922000000-230d11720b48c3f42a8c
Source of Spectrum RCM-12-1155-Bisoprolol-BBA
Wiley ID 1837753