CID 59172009

915376-57-7

Structural Information

Molecular Formula
C15H16NO3P
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2CCCP(=O)(O)O
InChI
InChI=1S/C15H16NO3P/c17-20(18,19)11-5-10-16-14-8-3-1-6-12(14)13-7-2-4-9-15(13)16/h1-4,6-9H,5,10-11H2,(H2,17,18,19)
InChIKey
SYPSXKFLPUSGSP-UHFFFAOYSA-N
Compound name
3-carbazol-9-ylpropylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

289.0868 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.09408 167.9
[M+Na]+ 312.07602 176.6
[M-H]- 288.07952 168.7
[M+NH4]+ 307.12062 185.3
[M+K]+ 328.04996 171.7
[M+H-H2O]+ 272.08406 159.2
[M+HCOO]- 334.08500 191.9
[M+CH3COO]- 348.10065 196.8
[M+Na-2H]- 310.06147 171.8
[M]+ 289.08625 171.0
[M]- 289.08735 171.0
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