CID 29875

19961-92-3

Structural Information

Molecular Formula
C12H16N2O4
SMILES
CN(C)C(=O)OC1=CC=CC(=C1)N(C)C(=O)OC
InChI
InChI=1S/C12H16N2O4/c1-13(2)11(15)18-10-7-5-6-9(8-10)14(3)12(16)17-4/h5-8H,1-4H3
InChIKey
NRUBYAXMLCSEJN-UHFFFAOYSA-N
Compound name
[3-[methoxycarbonyl(methyl)amino]phenyl] N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.11101 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.11829 156.1
[M+Na]+ 275.10023 165.2
[M+NH4]+ 270.14483 162.2
[M+K]+ 291.07417 162.0
[M-H]- 251.10373 157.5
[M+Na-2H]- 273.08568 160.9
[M]+ 252.11046 157.4
[M]- 252.11156 157.4
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

No patent data available for this compound.