CID 272954

15580-66-2

Structural Information

Molecular Formula
C7H14N2O2
SMILES
CN1CCC(CC1)(C(=O)O)N
InChI
InChI=1S/C7H14N2O2/c1-9-4-2-7(8,3-5-9)6(10)11/h2-5,8H2,1H3,(H,10,11)
InChIKey
PRROBIIYGSUPNR-UHFFFAOYSA-N
Compound name
4-amino-1-methylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

160
Patents

158.10553 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.112806 134.4
[M+Na]+ 181.094748 140.1
[M-H]- 157.098254 134.5
[M+NH4]+ 176.139353 154.5
[M+K]+ 197.068688 139.2
[M+H-H2O]+ 141.102790 129.2
[M+HCOO]- 203.103731 152.5
[M+CH3COO]- 217.119381 175.4
[M+Na-2H]- 179.080196 138.7
[M]+ 158.10498142 128.4
[M]- 158.10607858 128.4
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