CID 9576605

Alpha-hydroxyacetophenone carbmethoxy hydrazone

Structural Information

Molecular Formula
C10H12N2O3
SMILES
COC(=O)N/N=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)/b11-9-
InChIKey
XVTUURKWLLHGKX-LUAWRHEFSA-N
Compound name
methyl N-[(E)-(2-hydroxy-1-phenylethylidene)amino]carbamate
Related CIDs

2D Structure

compound 2d structure
2
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]+ 209.092076 144.7
[M+Na]+ 231.074018 150.0
[M-H]- 207.077524 148.2
[M+NH4]+ 226.118623 162.6
[M+K]+ 247.047958 149.2
[M+H-H2O]+ 191.082060 137.7
[M+HCOO]- 253.083001 170.1
[M+CH3COO]- 267.098651 188.3
[M+Na-2H]- 229.059466 150.4
[M]+ 208.08425142 144.8
[M]- 208.08534858 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.