CID 3025276

102402-46-0

Structural Information

Molecular Formula
C7H14NO5P
SMILES
C1CCC(C(C1)C(=O)O)(N)P(=O)(O)O
InChI
InChI=1S/C7H14NO5P/c8-7(14(11,12)13)4-2-1-3-5(7)6(9)10/h5H,1-4,8H2,(H,9,10)(H2,11,12,13)
InChIKey
XGOLWEOIUIGXPS-UHFFFAOYSA-N
Compound name
2-amino-2-phosphonocyclohexane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.06096 Da
Monoisotopic Mass

-3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.068236 147.6
[M+Na]+ 246.050178 152.3
[M-H]- 222.053684 145.0
[M+NH4]+ 241.094783 165.3
[M+K]+ 262.024118 151.1
[M+H-H2O]+ 206.058220 141.7
[M+HCOO]- 268.059161 168.2
[M+CH3COO]- 282.074811 181.2
[M+Na-2H]- 244.035626 148.9
[M]+ 223.06041142 142.0
[M]- 223.06150858 142.0
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.