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3,9-Dihexyl-9-boranyl-1,11-dimethyl-3,9-diazatricyclo[6.4.0.2(2,5)]dodec-11-ene-4-one
SpectraBase Compound ID En0qdXT6zN6
InChI InChI=1S/C24H45BN2O/c1-5-7-9-11-14-26-22-19(3)17-20(23(26)28)21-13-16-27(25,18-24(21,22)4)15-12-10-8-6-2/h17,20-22H,5-16,18H2,1-4,25H3/t20-,21+,22+,24+,27+/m1/s1
InChIKey ZNBRAOVZPLFBKO-GHFMNVAXSA-N
Mol Weight 386.4 g/mol
Molecular Formula C24H43BN2O
Exact Mass 386.346844 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRsrSLcVsaq
Name 3,9-Dihexyl-9-boranyl-1,11-dimethyl-3,9-diazatricyclo[6.4.0.2(2,5)]dodec-11-ene-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H45BN2O
InChI InChI=1S/C24H45BN2O/c1-5-7-9-11-14-26-22-19(3)17-20(23(26)28)21-13-16-27(25,18-24(21,22)4)15-12-10-8-6-2/h17,20-22H,5-16,18H2,1-4,25H3/t20-,21+,22+,24+,27+/m1/s1
InChIKey ZNBRAOVZPLFBKO-GHFMNVAXSA-N
Molecular Weight 386.431 g/mol
SMILES [BH-][N@@+]1(C[C@@]2([C@]3(N(CCCCCC)C([C@@]([C@@]2(CC1)[H])(C=C3C)[H])=O)[H])C)CCCCCC
SPLASH splash10-004i-0900000000-fe6c7d960e14f105c7c7
Source of Spectrum J-66-4901-18
Wiley ID 1535578