CID 482317

3955-57-5

Structural Information

Molecular Formula
C18H20N2O2
SMILES
C1=CC=C(C(=C1)C=NCCCCN=CC2=CC=CC=C2O)O
InChI
InChI=1S/C18H20N2O2/c21-17-9-3-1-7-15(17)13-19-11-5-6-12-20-14-16-8-2-4-10-18(16)22/h1-4,7-10,13-14,21-22H,5-6,11-12H2
InChIKey
CCJAYIGMMRQRAO-UHFFFAOYSA-N
Compound name
2-[4-[(2-hydroxyphenyl)methylideneamino]butyliminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

9616
Patents

296.15247 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.15975 169.9
[M+Na]+ 319.14169 175.5
[M-H]- 295.14519 176.1
[M+NH4]+ 314.18629 184.5
[M+K]+ 335.11563 170.5
[M+H-H2O]+ 279.14973 161.1
[M+HCOO]- 341.15067 195.8
[M+CH3COO]- 355.16632 207.4
[M+Na-2H]- 317.12714 175.2
[M]+ 296.15192 171.0
[M]- 296.15302 171.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe