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1H-Pyrazole, 1-(9-borabicyclo[3.3.1]non-9-yl)-3,5-bis(tricyclo[3.3.1.13,7]dec-1-yl)-
SpectraBase Compound ID 1SZQ30H8YhW
InChI InChI=1S/C31H45BN2/c1-3-26-5-2-6-27(4-1)32(26)34-28(30-24-11-19-7-20(13-24)14-25(30)12-19)15-29(33-34)31-16-21-8-22(17-31)10-23(9-21)18-31/h15,19-27,30H,1-14,16-18H2/t19-,20+,21-,22+,23-,24-,25+,26-,27+,30-,31-
InChIKey LPJHQEPMDYNDMK-GMITYKDLSA-N
Mol Weight 456.5 g/mol
Molecular Formula C31H45BN2
Exact Mass 456.36758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxWxSYtYHei
Name 1H-PYRAZOLE, 1-(9-BORABICYCLO[3.3.1]NON-9-YL)-3,5-BIS(TRICYCLO[3.3.1.13,7]DEC-1-YL)-
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C31H45N2B
InChI InChI=1S/C31H45BN2/c1-3-26-5-2-6-27(4-1)32(26)34-28(30-24-11-19-7-20(13-24)14-25(30)12-19)15-29(33-34)31-16-21-8-22(17-31)10-23(9-21)18-31/h15,19-27,30H,1-14,16-18H2/t19-,20+,21-,22+,23-,24-,25+,26-,27+,30-,31-
InChIKey LPJHQEPMDYNDMK-GMITYKDLSA-N
Instrument Name 311A
Molecular Weight 456.3665
SMILES c1(C2[C@]3(C[C@@]4(C[C@@](C[C@]2(C4)[H])(C3)[H])[H])[H])[n](B2[C@]3(CCC[C@@]2(CCC3)[H])[H])nc(C23C[C@]4(C[C@](C[C@](C4)(C3)[H])(C2)[H])[H])c1
SPLASH splash10-0a4i-2105900000-a8ba8160a076989c2ca1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany