CID 3061920

4-chloro-2-((2-chlorophenyl)(decylimino)methyl)phenol

Structural Information

Molecular Formula
C23H29Cl2NO
SMILES
CCCCCCCCCCN=C(C1=CC=CC=C1Cl)C2=C(C=CC(=C2)Cl)O
InChI
InChI=1S/C23H29Cl2NO/c1-2-3-4-5-6-7-8-11-16-26-23(19-12-9-10-13-21(19)25)20-17-18(24)14-15-22(20)27/h9-10,12-15,17,27H,2-8,11,16H2,1H3
InChIKey
MTGQPUCHLANETA-UHFFFAOYSA-N
Compound name
4-chloro-2-[C-(2-chlorophenyl)-N-decylcarbonimidoyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.16263 Da
Monoisotopic Mass

8.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.16991 200.2
[M+Na]+ 428.15185 206.1
[M-H]- 404.15535 204.9
[M+NH4]+ 423.19645 212.4
[M+K]+ 444.12579 197.4
[M+H-H2O]+ 388.15989 192.6
[M+HCOO]- 450.16083 212.3
[M+CH3COO]- 464.17648 226.0
[M+Na-2H]- 426.13730 199.0
[M]+ 405.16208 206.5
[M]- 405.16318 206.5
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.