CID 118545453

3-(aminomethyl)bicyclo[1.1.1]pentane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H11NO2
SMILES
C1C2(CC1(C2)C(=O)O)CN
InChI
InChI=1S/C7H11NO2/c8-4-6-1-7(2-6,3-6)5(9)10/h1-4,8H2,(H,9,10)
InChIKey
OMSDZSWHARMRFI-UHFFFAOYSA-N
Compound name
3-(aminomethyl)bicyclo[1.1.1]pentane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

141.07898 Da
Monoisotopic Mass

-2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.08626 150.4
[M+Na]+ 164.06820 146.2
[M+NH4]+ 159.11280 149.7
[M+K]+ 180.04214 144.5
[M-H]- 140.07170 142.8
[M+Na-2H]- 162.05365 145.8
[M]+ 141.07843 144.9
[M]- 141.07953 144.9
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

patents stripe