CID 3492020

2190-95-6

Structural Information

Molecular Formula
C12H27OP
SMILES
CCCCCCCCCCP(=O)(C)C
InChI
InChI=1S/C12H27OP/c1-4-5-6-7-8-9-10-11-12-14(2,3)13/h4-12H2,1-3H3
InChIKey
GSVLCKASFMVUSW-UHFFFAOYSA-N
Compound name
1-dimethylphosphoryldecane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

12
References

2283
Patents

218.17995 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.18723 161.5
[M+Na]+ 241.16917 166.7
[M-H]- 217.17267 159.8
[M+NH4]+ 236.21377 181.1
[M+K]+ 257.14311 164.8
[M+H-H2O]+ 201.17721 154.3
[M+HCOO]- 263.17815 187.3
[M+CH3COO]- 277.19380 194.0
[M+Na-2H]- 239.15462 162.2
[M]+ 218.17940 167.2
[M]- 218.18050 167.2
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