CID 135537323

2-[(e)-[(2,5-dimethyl-4-quinolyl)hydrazono]methyl]phenol

Structural Information

Molecular Formula
C18H17N3O
SMILES
CC1=C2C(=CC=C1)N=C(C=C2N/N=C/C3=CC=CC=C3O)C
InChI
InChI=1S/C18H17N3O/c1-12-6-5-8-15-18(12)16(10-13(2)20-15)21-19-11-14-7-3-4-9-17(14)22/h3-11,22H,1-2H3,(H,20,21)/b19-11+
InChIKey
CYNVWSHRQICPHZ-YBFXNURJSA-N
Compound name
2-[(E)-[(2,5-dimethylquinolin-4-yl)hydrazinylidene]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.13718 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.14446 168.1
[M+Na]+ 314.12640 176.7
[M-H]- 290.12990 174.8
[M+NH4]+ 309.17100 183.0
[M+K]+ 330.10034 170.9
[M+H-H2O]+ 274.13444 158.8
[M+HCOO]- 336.13538 191.9
[M+CH3COO]- 350.15103 179.7
[M+Na-2H]- 312.11185 175.3
[M]+ 291.13663 168.6
[M]- 291.13773 168.6
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.