CID 112493

62501-40-0

Structural Information

Molecular Formula
C10H12N2O3
SMILES
COC(=O)NN=C(CO)C1=CC=CC=C1
InChI
InChI=1S/C10H12N2O3/c1-15-10(14)12-11-9(7-13)8-5-3-2-4-6-8/h2-6,13H,7H2,1H3,(H,12,14)
InChIKey
XVTUURKWLLHGKX-UHFFFAOYSA-N
Compound name
methyl N-[(2-hydroxy-1-phenylethylidene)amino]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.0848 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.09208 144.7
[M+Na]+ 231.07402 150.0
[M-H]- 207.07752 148.2
[M+NH4]+ 226.11862 162.6
[M+K]+ 247.04796 149.2
[M+H-H2O]+ 191.08206 137.7
[M+HCOO]- 253.08300 170.1
[M+CH3COO]- 267.09865 188.3
[M+Na-2H]- 229.05947 150.4
[M]+ 208.08425 144.8
[M]- 208.08535 144.8
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.