CID 983

Triphosphoric acid

Structural Information

Molecular Formula
H5O10P3
SMILES
OP(=O)(O)OP(=O)(O)OP(=O)(O)O
InChI
InChI=1S/H5O10P3/c1-11(2,3)9-13(7,8)10-12(4,5)6/h(H,7,8)(H2,1,2,3)(H2,4,5,6)
InChIKey
UNXRWKVEANCORM-UHFFFAOYSA-N
Compound name
diphosphono hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

1128
References

155592
Patents

257.90955 Da
Monoisotopic Mass

-4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.916826 149.6
[M+Na]+ 280.898768 149.4
[M-H]- 256.902274 151.3
[M+NH4]+ 275.943373 148.4
[M+K]+ 296.872708 136.6
[M+H-H2O]+ 240.906810 139.1
[M+HCOO]- 302.907751 169.5
[M+CH3COO]- 316.923401 179.4
[M+Na-2H]- 278.884216 154.9
[M]+ 257.90900142 145.2
[M]- 257.91009858 145.2
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