CID 5331442

76193-67-4

Structural Information

Molecular Formula
C14H13NO2
SMILES
C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/O
InChI
InChI=1S/C14H13NO2/c16-15-10-12-6-8-14(9-7-12)17-11-13-4-2-1-3-5-13/h1-10,16H,11H2/b15-10+
InChIKey
SLNVTNZIMUJWQW-XNTDXEJSSA-N
Compound name
(NE)-N-[(4-phenylmethoxyphenyl)methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

30
Patents

227.09464 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.101916 149.1
[M+Na]+ 250.083858 156.0
[M-H]- 226.087364 155.8
[M+NH4]+ 245.128463 166.6
[M+K]+ 266.057798 152.6
[M+H-H2O]+ 210.091900 141.3
[M+HCOO]- 272.092841 175.2
[M+CH3COO]- 286.108491 190.6
[M+Na-2H]- 248.069306 156.8
[M]+ 227.09409142 149.9
[M]- 227.09518858 149.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe