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Boron, bis[.mu.-(4-bromo-1H-pyrazolato-N1:N2)]di-1,5-cyclooctanediyldi-
SpectraBase Compound ID FOvOYwCQBUE
InChI InChI=1S/C22H32B2Br2N4/c25-21-13-27-23(17-5-1-6-18(23)8-2-7-17)28-14-22(26)16-30(28)24(29(27)15-21)19-9-3-10-20(24)12-4-11-19/h13-20H,1-12H2
InChIKey ARHYVJLZCGYGTJ-UHFFFAOYSA-N
Mol Weight 534.0 g/mol
Molecular Formula C22H32B2Br2N4
Exact Mass 532.117983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4xtb2AvOYd
Name Boron, bis[.mu.-(4-bromo-1H-pyrazolato-N1:N2)]di-1,5-cyclooctanediyldi-
CAS Registry Number 125995-72-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32B2Br2N4
InChI InChI=1S/C22H32B2Br2N4/c25-21-13-27-23(17-5-1-6-18(23)8-2-7-17)28-14-22(26)16-30(28)24(29(27)15-21)19-9-3-10-20(24)12-4-11-19/h13-20H,1-12H2
InChIKey ARHYVJLZCGYGTJ-UHFFFAOYSA-N
Molecular Weight 533.954 g/mol
SMILES C=1(Br)C=[N]2[N](=[B]3(C4CCCC3CCC4)[N]=3[N](C=C(C3)Br)=[B]22C3CCCC2CCC3)C1
SPLASH splash10-00kb-0950000000-e52474234993748b1a1f
Source of Spectrum K-123-1280-0
Wiley ID 1403542