CID 44204854

1986990-18-4

Structural Information

Molecular Formula
C7H11NO2
SMILES
C1C[C@H]2[C@@H](C[C@@H]1N2)C(=O)O
InChI
InChI=1S/C7H11NO2/c9-7(10)5-3-4-1-2-6(5)8-4/h4-6,8H,1-3H2,(H,9,10)/t4-,5-,6+/m1/s1
InChIKey
ABNBSYHDPQDEOA-PBXRRBTRSA-N
Compound name
(1S,2R,4R)-7-azabicyclo[2.2.1]heptane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

15
Patents

141.07898 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.08626 129.6
[M+Na]+ 164.06820 136.7
[M+NH4]+ 159.11280 137.6
[M+K]+ 180.04214 136.4
[M-H]- 140.07170 127.5
[M+Na-2H]- 162.05365 129.4
[M]+ 141.07843 129.4
[M]- 141.07953 129.4
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.