CID 693797

183673-71-4

Structural Information

Molecular Formula
C11H20N2O4
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)N
InChI
InChI=1S/C11H20N2O4/c1-10(2,3)17-9(16)13-6-4-11(12,5-7-13)8(14)15/h4-7,12H2,1-3H3,(H,14,15)
InChIKey
YNHLVALLAURVJF-UHFFFAOYSA-N
Compound name
4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

289
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

literature stripe

Patent stripe

patents stripe