CID 482320

Rd3-0174

Structural Information

Molecular Formula
C18H20N2O2
SMILES
CC(C(C)N=CC1=CC=CC=C1O)N=CC2=CC=CC=C2O
InChI
InChI=1S/C18H20N2O2/c1-13(19-11-15-7-3-5-9-17(15)21)14(2)20-12-16-8-4-6-10-18(16)22/h3-14,21-22H,1-2H3
InChIKey
CUBYBPBDWDVROB-UHFFFAOYSA-N
Compound name
2-[3-[(2-hydroxyphenyl)methylideneamino]butan-2-yliminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

296.15247 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.15975 171.2
[M+Na]+ 319.14169 176.2
[M-H]- 295.14519 177.7
[M+NH4]+ 314.18629 185.6
[M+K]+ 335.11563 172.4
[M+H-H2O]+ 279.14973 162.7
[M+HCOO]- 341.15067 195.1
[M+CH3COO]- 355.16632 209.2
[M+Na-2H]- 317.12714 174.0
[M]+ 296.15192 171.1
[M]- 296.15302 171.1
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.