CID 139022697

2344679-50-9

Structural Information

Molecular Formula
C11H20N2O4
SMILES
CC(C)(C)OC(=O)NCC1CN(C1)CC(=O)O
InChI
InChI=1S/C11H20N2O4/c1-11(2,3)17-10(16)12-4-8-5-13(6-8)7-9(14)15/h8H,4-7H2,1-3H3,(H,12,16)(H,14,15)
InChIKey
FNPWJPLVWXFPKN-UHFFFAOYSA-N
Compound name
2-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]azetidin-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.1423 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.14958 162.7
[M+Na]+ 267.13152 164.4
[M+NH4]+ 262.17612 162.9
[M+K]+ 283.10546 164.2
[M-H]- 243.13502 157.2
[M+Na-2H]- 265.11697 160.3
[M]+ 244.14175 159.6
[M]- 244.14285 159.6
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.