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9-Phenyl-9-borabarbaralane trimethylamine
SpectraBase Compound ID 35kPhXRsxvC
InChI InChI=1S/C14H13B.C3H9N/c1-2-4-10(5-3-1)15-11-6-8-12-13(9-7-11)14(12)15;1-4(2)3/h1-9,11-14H;1-3H3/t11-,12+,13-,14+;
InChIKey VBCWORUSYMBDKZ-ZXLOZMCJSA-N
Mol Weight 251.2 g/mol
Molecular Formula C17H22BN
Exact Mass 251.18453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6xN9Ka0R3o
Name 9-Phenyl-9-borabarbaralane trimethylamine
Alternate Name(s) N,N-dimethylmethanamine compound with 9-phenyl-9-boratricyclo[3.3.1.0(2,8)]nona-3,6-diene (1:1)
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22BN
InChI InChI=1S/C14H13B.C3H9N/c1-2-4-10(5-3-1)15-11-6-8-12-13(9-7-11)14(12)15;1-4(2)3/h1-9,11-14H;1-3H3/t11-,12+,13-,14+;
InChIKey VBCWORUSYMBDKZ-ZXLOZMCJSA-N
Molecular Weight 251.180 g/mol
SMILES CN(C)C.[C@]12([C@]3(C=C[C@](B2c2ccccc2)(C=C[C@@]13[H])[H])[H])[H]
SPLASH splash10-03di-0900000000-35dd635af2ab83d3e03e
Source of Spectrum QE-2-460-2
Wiley ID 842485