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1-((3aR,6aS)-6a-Methyl-2-phenyl-tetrahydro-cyclopenta[1,3,2]dioxaborol-3a-yl)-3-phenyl-propan-1-one
SpectraBase Compound ID DlmCP2BeOQx
InChI InChI=1S/C21H23BO3/c1-20-15-8-16-21(20,19(23)14-13-17-9-4-2-5-10-17)25-22(24-20)18-11-6-3-7-12-18/h2-7,9-12H,8,13-16H2,1H3/t20-,21-/m0/s1
InChIKey DURNAYCPWJUDBF-SFTDATJTSA-N
Mol Weight 334.2 g/mol
Molecular Formula C21H23BO3
Exact Mass 334.174025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4UPHUS2dgPh
Name 1-((3aR,6aS)-6a-Methyl-2-phenyl-tetrahydro-cyclopenta[1,3,2]dioxaborol-3a-yl)-3-phenyl-propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23BO3
InChI InChI=1S/C21H23BO3/c1-20-15-8-16-21(20,19(23)14-13-17-9-4-2-5-10-17)25-22(24-20)18-11-6-3-7-12-18/h2-7,9-12H,8,13-16H2,1H3/t20-,21-/m0/s1
InChIKey DURNAYCPWJUDBF-SFTDATJTSA-N
Molecular Weight 334.222 g/mol
SMILES [C@@]12(OB(c3ccccc3)O[C@]1(CCC2)C)C(=O)CCc1ccccc1
SPLASH splash10-0udj-5091000000-d0e02aa47afad4ecec7a
Source of Spectrum F4-43-1540-3f
Synonyms 6a-Methyl-2-phenyl-3a-(3-phenylpropanoyl)-4H-tetrahydrocyclopenta[1,3,2]dioxaborole
Wiley ID 1690841