CID 28064656

2-[cyclopentyl(methyl)amino]acetic acid

Structural Information

Molecular Formula
C8H15NO2
SMILES
CN(CC(=O)O)C1CCCC1
InChI
InChI=1S/C8H15NO2/c1-9(6-8(10)11)7-4-2-3-5-7/h7H,2-6H2,1H3,(H,10,11)
InChIKey
DARPVXNMSUKSIG-UHFFFAOYSA-N
Compound name
2-[cyclopentyl(methyl)amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

157.11028 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 136.0
[M+Na]+ 180.09950 140.4
[M-H]- 156.10300 138.9
[M+NH4]+ 175.14410 157.9
[M+K]+ 196.07344 140.6
[M+H-H2O]+ 140.10754 130.3
[M+HCOO]- 202.10848 158.2
[M+CH3COO]- 216.12413 178.8
[M+Na-2H]- 178.08495 138.2
[M]+ 157.10973 133.4
[M]- 157.11083 133.4
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

patents stripe