CID 389145

Nsc684829

Structural Information

Molecular Formula
C13H24O3P
SMILES
C1C2CC3CC1CC(C2)(C3)[P+](CO)(CO)CO
InChI
InChI=1S/C13H24O3P/c14-7-17(8-15,9-16)13-4-10-1-11(5-13)3-12(2-10)6-13/h10-12,14-16H,1-9H2/q+1
InChIKey
OCZIZUGXOJUBMO-UHFFFAOYSA-N
Compound name
1-adamantyl-tris(hydroxymethyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

259.1463 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.15358 168.1
[M+Na]+ 282.13552 168.3
[M-H]- 258.13902 158.5
[M+NH4]+ 277.18012 190.0
[M+K]+ 298.10946 159.8
[M+H-H2O]+ 242.14356 164.2
[M+HCOO]- 304.14450 174.2
[M+CH3COO]- 318.16015 190.3
[M+Na-2H]- 280.12097 178.0
[M]+ 259.14575 166.8
[M]- 259.14685 166.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.