CID 135686405

59986-55-9

Structural Information

Molecular Formula
C22H28ClNO2
SMILES
CCCCCCCCCC1=CC(=C(C(=C1)Cl)O)/C(=N\O)/C2=CC=CC=C2
InChI
InChI=1S/C22H28ClNO2/c1-2-3-4-5-6-7-9-12-17-15-19(22(25)20(23)16-17)21(24-26)18-13-10-8-11-14-18/h8,10-11,13-16,25-26H,2-7,9,12H2,1H3/b24-21-
InChIKey
FGTCYTZEIKWZRE-FLFQWRMESA-N
Compound name
2-chloro-6-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]-4-nonylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

373.18085 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.18813 192.7
[M+Na]+ 396.17007 198.0
[M-H]- 372.17357 197.1
[M+NH4]+ 391.21467 205.0
[M+K]+ 412.14401 190.7
[M+H-H2O]+ 356.17811 184.8
[M+HCOO]- 418.17905 209.0
[M+CH3COO]- 432.19470 218.8
[M+Na-2H]- 394.15552 192.5
[M]+ 373.18030 196.9
[M]- 373.18140 196.9
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.