CID 6870761

100136-52-5

Structural Information

Molecular Formula
C12H10N2O3
SMILES
C1=COC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)O
InChI
InChI=1S/C12H10N2O3/c15-10-5-3-9(4-6-10)12(16)14-13-8-11-2-1-7-17-11/h1-8,15H,(H,14,16)/b13-8+
InChIKey
PUORTCYBHNMXSD-MDWZMJQESA-N
Compound name
N-[(E)-furan-2-ylmethylideneamino]-4-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

230.06914 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.07642 148.8
[M+Na]+ 253.05836 155.6
[M-H]- 229.06186 156.6
[M+NH4]+ 248.10296 166.2
[M+K]+ 269.03230 154.1
[M+H-H2O]+ 213.06640 141.5
[M+HCOO]- 275.06734 175.8
[M+CH3COO]- 289.08299 191.0
[M+Na-2H]- 251.04381 155.2
[M]+ 230.06859 149.6
[M]- 230.06969 149.6
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