CID 58034

P-aminobenzoic acid 2-(methoxymethylamino)ethyl ester

Structural Information

Molecular Formula
C11H16N2O3
SMILES
CN(CCOC(=O)C1=CC=C(C=C1)N)OC
InChI
InChI=1S/C11H16N2O3/c1-13(15-2)7-8-16-11(14)9-3-5-10(12)6-4-9/h3-6H,7-8,12H2,1-2H3
InChIKey
KRMCSAZWAFLZCC-UHFFFAOYSA-N
Compound name
2-[methoxy(methyl)amino]ethyl 4-aminobenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.11609 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.123366 150.0
[M+Na]+ 247.105308 155.8
[M-H]- 223.108814 154.5
[M+NH4]+ 242.149913 168.0
[M+K]+ 263.079248 155.9
[M+H-H2O]+ 207.113350 142.7
[M+HCOO]- 269.114291 175.7
[M+CH3COO]- 283.129941 196.6
[M+Na-2H]- 245.090756 154.0
[M]+ 224.11554142 152.6
[M]- 224.11663858 152.6
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.