CID 739516

4-hydroxybenzoic acid 2-[[4-(1-methylethyl)phenyl]methylene]hydrazide

Structural Information

Molecular Formula
C17H18N2O2
SMILES
CC(C)C1=CC=C(C=C1)C=NNC(=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)
InChIKey
IKPPIUNQWSRCOZ-UHFFFAOYSA-N
Compound name
4-hydroxy-N-[(4-propan-2-ylphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

38
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 166.6
[M+Na]+ 305.12606 172.1
[M-H]- 281.12956 173.3
[M+NH4]+ 300.17066 181.7
[M+K]+ 321.10000 168.5
[M+H-H2O]+ 265.13410 158.3
[M+HCOO]- 327.13504 190.9
[M+CH3COO]- 341.15069 206.2
[M+Na-2H]- 303.11151 170.0
[M]+ 282.13629 166.2
[M]- 282.13739 166.2
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

patents stripe