Debug Info

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3-tert-butyl-5-((2-cyclopentylphenoxy)methyl)-2-phenyl-1,3,2-oxazaborolidine
SpectraBase Compound ID 5ybtsWzWpJM
InChI InChI=1S/C24H32BNO2/c1-24(2,3)26-17-21(28-25(26)20-13-5-4-6-14-20)18-27-23-16-10-9-15-22(23)19-11-7-8-12-19/h4-6,9-10,13-16,19,21H,7-8,11-12,17-18H2,1-3H3
InChIKey CYVJTPIRIOLJLL-UHFFFAOYSA-N
Mol Weight 377.3 g/mol
Molecular Formula C24H32BNO2
Exact Mass 377.252609 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pK6RMvOLkP
Name 3-tert-butyl-5-((2-cyclopentylphenoxy)methyl)-2-phenyl-1,3,2-oxazaborolidine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32BNO2
InChI InChI=1S/C24H32BNO2/c1-24(2,3)26-17-21(28-25(26)20-13-5-4-6-14-20)18-27-23-16-10-9-15-22(23)19-11-7-8-12-19/h4-6,9-10,13-16,19,21H,7-8,11-12,17-18H2,1-3H3
InChIKey CYVJTPIRIOLJLL-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 377.335 g/mol
SMILES C1N(B(OC1COc1c(cccc1)C1CCCC1)c1ccccc1)C(C)(C)C
SPLASH splash10-03di-5709000000-0ab8cb5a8356407df009
Source of Spectrum RCM-12-1154-Penbutolol-PBA
Wiley ID 1837761
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