CID 58242

101265-52-5

Structural Information

Molecular Formula
C13H18N2O3
SMILES
CCOC(=O)N(CC(=O)N(C)C)C1=CC=CC=C1
InChI
InChI=1S/C13H18N2O3/c1-4-18-13(17)15(10-12(16)14(2)3)11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3
InChIKey
KKKOWMCMYOJAPU-UHFFFAOYSA-N
Compound name
ethyl N-[2-(dimethylamino)-2-oxoethyl]-N-phenylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.13174 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.13902 158.8
[M+Na]+ 273.12096 163.1
[M-H]- 249.12446 164.7
[M+NH4]+ 268.16556 176.3
[M+K]+ 289.09490 164.5
[M+H-H2O]+ 233.12900 151.0
[M+HCOO]- 295.12994 184.2
[M+CH3COO]- 309.14559 204.2
[M+Na-2H]- 271.10641 161.4
[M]+ 250.13119 162.5
[M]- 250.13229 162.5
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.