SpectraBase Spectrum ID |
Ly494vhRhrv |
Name |
2,5-bis(Diphenylphosphino)-1,4.3,6-dianhydro-2,5-dideoxy-L-iditol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
482.156454136 u |
Formula |
C30H28O2P2 |
InChI |
InChI=1S/C30H28O2P2/c1-5-13-23(14-6-1)33(24-15-7-2-8-16-24)27-21-31-30-28(22-32-29(27)30)34(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27-30H,21-22H2/t27-,28-,29+,30+/m0/s1 |
InChIKey |
CAQFAZUOBNAEFR-VZNYXHRGSA-N |
Molecular Weight |
482.500 g/mol |
SMILES |
C1=CC=C(P([C@]2(CO[C@]3([C@@]2(OC[C@@]3(P(C=2C=CC=CC2)C=2C=CC=CC2)[H])[H])[H])[H])C=2C=CC=CC2)C=C1 |
Spectrum/Structure Validation Score (Raman) |
0.985809 |