CID 138039479

2202413-45-2

Structural Information

Molecular Formula
C10H19NO3
SMILES
CN1CCC(CC1)(CCOC)C(=O)O
InChI
InChI=1S/C10H19NO3/c1-11-6-3-10(4-7-11,9(12)13)5-8-14-2/h3-8H2,1-2H3,(H,12,13)
InChIKey
QVPJYXUWINVLGH-UHFFFAOYSA-N
Compound name
4-(2-methoxyethyl)-1-methylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

201.13649 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.143766 146.1
[M+Na]+ 224.125708 151.3
[M-H]- 200.129214 146.2
[M+NH4]+ 219.170313 165.1
[M+K]+ 240.099648 150.6
[M+H-H2O]+ 184.133750 140.5
[M+HCOO]- 246.134691 163.0
[M+CH3COO]- 260.150341 182.2
[M+Na-2H]- 222.111156 149.7
[M]+ 201.13594142 144.4
[M]- 201.13703858 144.4
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