CID 9833984

Lesogaberan

Structural Information

Molecular Formula
C3H8FNO2P
SMILES
C([C@H](C[P+](=O)O)F)N
InChI
InChI=1S/C3H7FNO2P/c4-3(1-5)2-8(6)7/h3H,1-2,5H2/p+1/t3-/m1/s1
InChIKey
WVTGPBOMAQLPCP-GSVOUGTGSA-O
Compound name
[(2R)-3-amino-2-fluoropropyl]-hydroxy-oxophosphanium
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

33
References

277
Patents

140.02766 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.03494 127.1
[M+Na]+ 163.01688 133.8
[M-H]- 139.02038 123.7
[M+NH4]+ 158.06148 147.7
[M+K]+ 178.99082 128.1
[M+H-H2O]+ 123.02492 122.5
[M+HCOO]- 185.02586 153.3
[M+CH3COO]- 199.04151 166.7
[M+Na-2H]- 161.00233 130.1
[M]+ 140.02711 123.6
[M]- 140.02821 123.6
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