CID 6328375

Mercury acetate, (bis-(heptyloxy)phosphinyl)-

Structural Information

Molecular Formula
C14H30O3P
SMILES
CCCCCCCO[P+](=O)OCCCCCCC
InChI
InChI=1S/C14H30O3P/c1-3-5-7-9-11-13-16-18(15)17-14-12-10-8-6-4-2/h3-14H2,1-2H3/q+1
InChIKey
QUMYKPNZEVGTCB-UHFFFAOYSA-N
Compound name
diheptoxy(oxo)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

102
Patents

277.19327 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.20055 176.7
[M+Na]+ 300.18249 180.3
[M-H]- 276.18599 174.6
[M+NH4]+ 295.22709 193.3
[M+K]+ 316.15643 173.6
[M+H-H2O]+ 260.19053 170.9
[M+HCOO]- 322.19147 202.6
[M+CH3COO]- 336.20712 197.4
[M+Na-2H]- 298.16794 177.0
[M]+ 277.19272 184.4
[M]- 277.19382 184.4
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