CID 6516895

Brn 2291296

Structural Information

Molecular Formula
C11H13N3O4
SMILES
CNC(=O)OC1=CC=CC=C1/C=N\OC(=O)NC
InChI
InChI=1S/C11H13N3O4/c1-12-10(15)17-9-6-4-3-5-8(9)7-14-18-11(16)13-2/h3-7H,1-2H3,(H,12,15)(H,13,16)/b14-7-
InChIKey
AHNIUPUJGQCNBZ-AUWJEWJLSA-N
Compound name
[2-[(Z)-methylcarbamoyloxyiminomethyl]phenyl] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.0906 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.09788 156.0
[M+Na]+ 274.07982 164.1
[M+NH4]+ 269.12442 161.2
[M+K]+ 290.05376 160.1
[M-H]- 250.08332 157.3
[M+Na-2H]- 272.06527 160.6
[M]+ 251.09005 156.9
[M]- 251.09115 156.9
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.