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]+ 156.10192 130.1
[M+Na]+ 178.08386 138.3
[M-H]- 154.08736 133.6
[M+NH4]+ 173.12846 147.7
[M+K]+ 194.05780 135.0
[M+H-H2O]+ 138.09190 125.4
[M+HCOO]- 200.09284 150.1
[M+CH3COO]- 214.10849 180.3
[M+Na-2H]- 176.06931 132.9
[M]+ 155.09409 129.3
[M]- 155.09519 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.