CID 24729642

368866-17-5

Structural Information

Molecular Formula
C11H20N2O4
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)(C(=O)O)N
InChI
InChI=1S/C11H20N2O4/c1-10(2,3)17-9(16)13-6-4-5-11(12,7-13)8(14)15/h4-7,12H2,1-3H3,(H,14,15)
InChIKey
OSYGMOYBKKZJES-UHFFFAOYSA-N
Compound name
3-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

244.1423 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.14958 155.9
[M+Na]+ 267.13152 160.5
[M-H]- 243.13502 155.7
[M+NH4]+ 262.17612 172.7
[M+K]+ 283.10546 160.3
[M+H-H2O]+ 227.13956 150.9
[M+HCOO]- 289.14050 170.8
[M+CH3COO]- 303.15615 190.3
[M+Na-2H]- 265.11697 158.4
[M]+ 244.14175 152.4
[M]- 244.14285 152.4
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