CID 139026261

2361645-03-4

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1C2C1CC(C2)C(C(=O)O)N
InChI
InChI=1S/C8H13NO2/c9-7(8(10)11)6-2-4-1-5(4)3-6/h4-7H,1-3,9H2,(H,10,11)
InChIKey
CGZXFSSOWGGUPN-UHFFFAOYSA-N
Compound name
2-amino-2-(3-bicyclo[3.1.0]hexanyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 130.1
[M+Na]+ 178.083858 138.3
[M-H]- 154.087364 133.6
[M+NH4]+ 173.128463 147.7
[M+K]+ 194.057798 135.0
[M+H-H2O]+ 138.091900 125.4
[M+HCOO]- 200.092841 150.1
[M+CH3COO]- 214.108491 180.3
[M+Na-2H]- 176.069306 132.9
[M]+ 155.09409142 129.3
[M]- 155.09518858 129.3
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.