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1-(9-Borabicyclo[3.3.1]non-9-yl)-3-methyl-5-phenyl-1H-pyrazole
SpectraBase Compound ID IK4zCLMGZdI
InChI InChI=1S/C18H23BN2/c1-14-13-18(15-7-3-2-4-8-15)21(20-14)19-16-9-5-10-17(19)12-6-11-16/h2-4,7-8,13,16-17H,5-6,9-12H2,1H3
InChIKey DZKDRFVUZHOADH-UHFFFAOYSA-N
Mol Weight 278.2 g/mol
Molecular Formula C18H23BN2
Exact Mass 278.195429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1HsLhKr5hc
Name 1-(9-Borabicyclo[3.3.1]non-9-yl)-3-methyl-5-phenyl-1H-pyrazole
CAS Registry Number 125995-69-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23BN2
InChI InChI=1S/C18H23BN2/c1-14-13-18(15-7-3-2-4-8-15)21(20-14)19-16-9-5-10-17(19)12-6-11-16/h2-4,7-8,13,16-17H,5-6,9-12H2,1H3
InChIKey DZKDRFVUZHOADH-UHFFFAOYSA-N
Molecular Weight 278.206 g/mol
SMILES C1CC2CCCC(B2[n]2c(cc(n2)C)-c2ccccc2)C1
SPLASH splash10-004i-4490000000-a3f9d229f54063e3a06e
Synonyms 1-(9-borabicyclo[3.3.1]nonan-9-yl)-3-methyl-5-phenyl-pyrazole 1H-Pyrazole, 1-(9-borabicyclo[3.3.1]non-9-yl)-3-methyl-5-phenyl-
Wiley ID 1496718