CID 26184

13684-67-8

Structural Information

Molecular Formula
C10H12N2O4
SMILES
CNC(=O)OC1=CC=CC(=C1)NC(=O)OC
InChI
InChI=1S/C10H12N2O4/c1-11-9(13)16-8-5-3-4-7(6-8)12-10(14)15-2/h3-6H,1-2H3,(H,11,13)(H,12,14)
InChIKey
HDAVBVTVMRHOEP-UHFFFAOYSA-N
Compound name
[3-(methoxycarbonylamino)phenyl] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.07971 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.08699 147.3
[M+Na]+ 247.06893 153.5
[M-H]- 223.07243 151.2
[M+NH4]+ 242.11353 164.9
[M+K]+ 263.04287 153.3
[M+H-H2O]+ 207.07697 140.3
[M+HCOO]- 269.07791 172.9
[M+CH3COO]- 283.09356 191.0
[M+Na-2H]- 245.05438 152.4
[M]+ 224.07916 149.1
[M]- 224.08026 149.1
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.