CID 2735642

156478-71-6

Structural Information

Molecular Formula
C11H20N2O4
SMILES
CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)O
InChI
InChI=1S/C11H20N2O4/c1-11(2,3)17-10(16)13-6-4-12(5-7-13)8-9(14)15/h4-8H2,1-3H3,(H,14,15)
InChIKey
WZBHMXRBXXCEDD-UHFFFAOYSA-N
Compound name
2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

568
Patents

244.1423 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.14958 156.3
[M+Na]+ 267.13152 163.6
[M+NH4]+ 262.17612 160.7
[M+K]+ 283.10546 161.6
[M-H]- 243.13502 153.2
[M+Na-2H]- 265.11697 157.3
[M]+ 244.14175 155.9
[M]- 244.14285 155.9
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