CID 202191

Brn 2873558

Structural Information

Molecular Formula
C15H16N2O3
SMILES
CCOC(=O)CNC(=O)NC1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C15H16N2O3/c1-2-20-14(18)10-16-15(19)17-13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,2,10H2,1H3,(H2,16,17,19)
InChIKey
UWNUTWBFIPHSRX-UHFFFAOYSA-N
Compound name
ethyl 2-(naphthalen-1-ylcarbamoylamino)acetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

272.1161 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.123376 160.9
[M+Na]+ 295.105318 166.2
[M-H]- 271.108824 165.0
[M+NH4]+ 290.149923 177.3
[M+K]+ 311.079258 163.7
[M+H-H2O]+ 255.113360 153.3
[M+HCOO]- 317.114301 184.4
[M+CH3COO]- 331.129951 202.2
[M+Na-2H]- 293.090766 166.9
[M]+ 272.11555142 162.0
[M]- 272.11664858 162.0
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.