This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C20H26O6P2


Canonical SMILES:
COP(=O)(c1cc2CCc3ccc(CCc1cc2P(=O)(OC)OC)cc3)OC
InChI:
InChI=1S/C20H26O6P2/c1-23-27(21,24-2)19-13-18-12-10-16-7-5-15(6-8-16)9-11-17(19)14-20(18)28(22,25-3)26-4/h5-8,13-14H,9-12H2,1-4H3
InChIKey:
GMDSCBQOTFRVGY-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2022-01-20This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

electron ionisation mass spectrometry (EI-MS) 
Author: Christoph Zippel1

1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (EI, 70 eV, 140 °C, %) m/z = 424 (100) [M+H]+, 320 (6) [M–C8H8]+, 104 (49) [C8H8]+. HRMS (EI, [M]+, C20H26O6P2) calcd.: 424.1199; found: 424.1201.
Datasets