CID 102521372

1-dimethylarsinoyl-heptadecane

Structural Information

Molecular Formula
C19H41AsO
SMILES
CCCCCCCCCCCCCCCCC[As](=O)(C)C
InChI
InChI=1S/C19H41AsO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)21/h4-19H2,1-3H3
InChIKey
MKBFOWMTLICLPK-UHFFFAOYSA-N
Compound name
1-dimethylarsorylheptadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.23734 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.24462 196.3
[M+Na]+ 383.22656 198.0
[M-H]- 359.23006 193.8
[M+NH4]+ 378.27116 211.4
[M+K]+ 399.20050 194.1
[M+H-H2O]+ 343.23460 189.3
[M+HCOO]- 405.23554 213.7
[M+CH3COO]- 419.25119 213.1
[M+Na-2H]- 381.21201 195.3
[M]+ 360.23679 203.3
[M]- 360.23789 203.3
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

No patent data available for this compound.