CID 2133265

Methyl 2-(2-(2-naphthyloxy)acetylamino)acetate

Structural Information

Molecular Formula
C15H15NO4
SMILES
COC(=O)CNC(=O)COC1=CC2=CC=CC=C2C=C1
InChI
InChI=1S/C15H15NO4/c1-19-15(18)9-16-14(17)10-20-13-7-6-11-4-2-3-5-12(11)8-13/h2-8H,9-10H2,1H3,(H,16,17)
InChIKey
CQKAYOOANAXTOX-UHFFFAOYSA-N
Compound name
methyl 2-[(2-naphthalen-2-yloxyacetyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.1001 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.10738 160.2
[M+Na]+ 296.08932 166.2
[M-H]- 272.09282 164.4
[M+NH4]+ 291.13392 176.8
[M+K]+ 312.06326 164.3
[M+H-H2O]+ 256.09736 152.8
[M+HCOO]- 318.09830 182.9
[M+CH3COO]- 332.11395 199.9
[M+Na-2H]- 294.07477 165.8
[M]+ 273.09955 163.6
[M]- 273.10065 163.6
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.