CID 4167036

82277-17-6

Structural Information

Molecular Formula
C12H22N2O4
SMILES
C1CCC(C1)OC(=O)NCCCCC(C(=O)O)N
InChI
InChI=1S/C12H22N2O4/c13-10(11(15)16)7-3-4-8-14-12(17)18-9-5-1-2-6-9/h9-10H,1-8,13H2,(H,14,17)(H,15,16)
InChIKey
ZHGGYCNHXLZKHG-UHFFFAOYSA-N
Compound name
2-amino-6-(cyclopentyloxycarbonylamino)hexanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

258.15796 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.16524 162.4
[M+Na]+ 281.14718 165.4
[M+NH4]+ 276.19178 166.7
[M+K]+ 297.12112 165.1
[M-H]- 257.15068 160.7
[M+Na-2H]- 279.13263 161.7
[M]+ 258.15741 161.4
[M]- 258.15851 161.4
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