CID 5331325

101574-65-6

Structural Information

Molecular Formula
C17H18N2O2
SMILES
CC(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=CC=C(C=C2)O
InChI
InChI=1S/C17H18N2O2/c1-12(2)14-5-3-13(4-6-14)11-18-19-17(21)15-7-9-16(20)10-8-15/h3-12,20H,1-2H3,(H,19,21)/b18-11+
InChIKey
IKPPIUNQWSRCOZ-WOJGMQOQSA-N
Compound name
4-hydroxy-N-[(E)-(4-propan-2-ylphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

33
Patents

282.13684 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.14412 167.8
[M+Na]+ 305.12606 179.8
[M+NH4]+ 300.17066 175.0
[M+K]+ 321.10000 173.0
[M-H]- 281.12956 172.5
[M+Na-2H]- 303.11151 175.8
[M]+ 282.13629 170.7
[M]- 282.13739 170.7
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