CID 4385243

1-cyclopentylazetidine-2-carboxylic acid

Structural Information

Molecular Formula
C9H15NO2
SMILES
C1CCC(C1)N2CCC2C(=O)O
InChI
InChI=1S/C9H15NO2/c11-9(12)8-5-6-10(8)7-3-1-2-4-7/h7-8H,1-6H2,(H,11,12)
InChIKey
FUCQOVYPBMMTMO-UHFFFAOYSA-N
Compound name
1-cyclopentylazetidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

169.11028 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.11756 134.7
[M+Na]+ 192.09950 138.4
[M-H]- 168.10300 138.0
[M+NH4]+ 187.14410 148.0
[M+K]+ 208.07344 140.1
[M+H-H2O]+ 152.10754 123.6
[M+HCOO]- 214.10848 152.2
[M+CH3COO]- 228.12413 179.0
[M+Na-2H]- 190.08495 135.9
[M]+ 169.10973 138.8
[M]- 169.11083 138.8
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