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5-((3-tert-butyl-2-butyl-1,3,2-oxazaborolidin-5-yl)methoxy)-3,4-dihydroquinolin-2(1H)-one
SpectraBase Compound ID JeYWEVW5VA3
InChI InChI=1S/C20H31BN2O3/c1-5-6-12-21-23(20(2,3)4)13-15(26-21)14-25-18-9-7-8-17-16(18)10-11-19(24)22-17/h7-9,15H,5-6,10-14H2,1-4H3,(H,22,24)
InChIKey QMGRDMOZOXXZGP-UHFFFAOYSA-N
Mol Weight 358.3 g/mol
Molecular Formula C20H31BN2O3
Exact Mass 358.242773 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6iUokN0Rmwj
Name 5-((3-tert-butyl-2-butyl-1,3,2-oxazaborolidin-5-yl)methoxy)-3,4-dihydroquinolin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31BN2O3
InChI InChI=1S/C20H31BN2O3/c1-5-6-12-21-23(20(2,3)4)13-15(26-21)14-25-18-9-7-8-17-16(18)10-11-19(24)22-17/h7-9,15H,5-6,10-14H2,1-4H3,(H,22,24)
InChIKey QMGRDMOZOXXZGP-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 358.289 g/mol
SMILES N1c2c(CCC1=O)c(ccc2)OCC1OB(CCCC)N(C1)C(C)(C)C
SPLASH splash10-0006-5729000000-3f729b08bae2f627bbf8
Source of Spectrum RCM-12-1157-Carteolol-BBA
Wiley ID 1837755