CID 54593128

2803863-62-7

Structural Information

Molecular Formula
C10H18N2O2
SMILES
C1CCC(C1)(C(=O)O)N2CCNCC2
InChI
InChI=1S/C10H18N2O2/c13-9(14)10(3-1-2-4-10)12-7-5-11-6-8-12/h11H,1-8H2,(H,13,14)
InChIKey
GQZDCAGCXOATAZ-UHFFFAOYSA-N
Compound name
1-piperazin-1-ylcyclopentane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.13683 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.144106 147.9
[M+Na]+ 221.126048 150.9
[M-H]- 197.129554 147.7
[M+NH4]+ 216.170653 165.8
[M+K]+ 237.099988 148.5
[M+H-H2O]+ 181.134090 140.6
[M+HCOO]- 243.135031 161.0
[M+CH3COO]- 257.150681 175.7
[M+Na-2H]- 219.111496 149.2
[M]+ 198.13628142 138.2
[M]- 198.13737858 138.2
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.