CID 46842

Arsine, trioctyl-

Structural Information

Molecular Formula
C24H51As
SMILES
CCCCCCCC[As](CCCCCCCC)CCCCCCCC
InChI
InChI=1S/C24H51As/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3/h4-24H2,1-3H3
InChIKey
QMMSODCNPHJWSN-UHFFFAOYSA-N
Compound name
trioctylarsane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

414.32068 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.32796 217.0
[M+Na]+ 437.30990 215.7
[M-H]- 413.31340 213.3
[M+NH4]+ 432.35450 229.8
[M+K]+ 453.28384 210.6
[M+H-H2O]+ 397.31794 208.6
[M+HCOO]- 459.31888 232.8
[M+CH3COO]- 473.33453 227.2
[M+Na-2H]- 435.29535 211.4
[M]+ 414.32013 224.9
[M]- 414.32123 224.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe