SpectraBase Spectrum ID |
BpwbbSc9vAT |
Name |
Butanedioic acid, 2-(triphenylphosphoranylidene)-, dibutyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
490.227296601 u |
Formula |
C30H35O4P |
InChI |
InChI=1S/C30H35O4P/c1-3-5-22-33-29(31)24-28(30(32)34-23-6-4-2)35(25-16-10-7-11-17-25,26-18-12-8-13-19-26)27-20-14-9-15-21-27/h7-21H,3-6,22-24H2,1-2H3 |
InChIKey |
DAFUSLOMBKTQOM-UHFFFAOYSA-N |
Molecular Weight |
490.580 g/mol |
SMILES |
C=1(P(=C(CC(OCCCC)=O)C(=O)OCCCC)(C=2C=CC=CC2)C2=CC=CC=C2)C=CC=CC1 |