CID 103165

Phenol, 2,2'-[(2-methyl-1,5-pentanediyl)bis(nitrilomethylidyne)]bis-

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CC(CCCN=CC1=CC=CC=C1O)CN=CC2=CC=CC=C2O
InChI
InChI=1S/C20H24N2O2/c1-16(13-22-15-18-9-3-5-11-20(18)24)7-6-12-21-14-17-8-2-4-10-19(17)23/h2-5,8-11,14-16,23-24H,6-7,12-13H2,1H3
InChIKey
IPIHECIYBVDAFT-UHFFFAOYSA-N
Compound name
2-[[5-[(2-hydroxyphenyl)methylideneamino]-4-methylpentyl]iminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.191056 179.7
[M+Na]+ 347.172998 184.1
[M-H]- 323.176504 185.6
[M+NH4]+ 342.217603 193.0
[M+K]+ 363.146938 179.2
[M+H-H2O]+ 307.181040 170.6
[M+HCOO]- 369.181981 203.9
[M+CH3COO]- 383.197631 214.3
[M+Na-2H]- 345.158446 182.7
[M]+ 324.18323142 180.9
[M]- 324.18432858 180.9
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.