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(Sp)-bis[(5R,6aR,9aR)-6-methyl-5-phenyl-decahydro-4-oxa-6-aza-5-phospha-cyclopenta[d]indene borane]methane
SpectraBase Compound ID GMPz1adJYJ2
InChI InChI=1S/C31H46B2N2O2P2/c32-38(24-11-3-1-4-12-24)34(26-15-7-19-30(26)21-9-17-28(30)36-38)23-35-27-16-8-20-31(27)22-10-18-29(31)37-39(35,33)25-13-5-2-6-14-25/h1-6,11-14,26-29,38-39H,7-10,15-23,32-33H2/t26-,27+,28?,29?,30-,31?/m1/s1
InChIKey BHXUTROUQMYAOV-GIIRLUIUSA-N
Mol Weight 562.3 g/mol
Molecular Formula C31H46B2N2O2P2
Exact Mass 562.322063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hm1k5PkDRGb
Name (Sp)-bis[(5R,6aR,9aR)-6-methyl-5-phenyl-decahydro-4-oxa-6-aza-5-phospha-cyclopenta[d]indene borane]methane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H46B2N2O2P2
InChI InChI=1S/C31H46B2N2O2P2/c32-38(24-11-3-1-4-12-24)34(26-15-7-19-30(26)21-9-17-28(30)36-38)23-35-27-16-8-20-31(27)22-10-18-29(31)37-39(35,33)25-13-5-2-6-14-25/h1-6,11-14,26-29,38-39H,7-10,15-23,32-33H2/t26-,27+,28?,29?,30-,31?/m1/s1
InChIKey BHXUTROUQMYAOV-GIIRLUIUSA-N
Molecular Weight 562.289 g/mol
SMILES P1(OC2CCCC22[C@@](N1CN1P(OC3CCC[C@]33[C@]1(CCC3)[H])(c1ccccc1)B)(CCC2)[H])(c1ccccc1)B
SPLASH splash10-00di-0090000000-68426b7dfe46e5a14979
Source of Spectrum QC-20-76-25
Wiley ID 1687934