CID 6410641

Cm 30339

Structural Information

Molecular Formula
C18H17N3O
SMILES
C1=CC=C(C=C1)C2=CC(=NN=C2NCCO)C3=CC=CC=C3
InChI
InChI=1S/C18H17N3O/c22-12-11-19-18-16(14-7-3-1-4-8-14)13-17(20-21-18)15-9-5-2-6-10-15/h1-10,13,22H,11-12H2,(H,19,21)
InChIKey
NGONQZDQPSKNFN-UHFFFAOYSA-N
Compound name
2-[(4,6-diphenylpyridazin-3-yl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

291.13718 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.14446 168.1
[M+Na]+ 314.12640 174.7
[M-H]- 290.12990 173.5
[M+NH4]+ 309.17100 179.1
[M+K]+ 330.10034 168.1
[M+H-H2O]+ 274.13444 157.4
[M+HCOO]- 336.13538 189.3
[M+CH3COO]- 350.15103 178.2
[M+Na-2H]- 312.11185 175.3
[M]+ 291.13663 166.4
[M]- 291.13773 166.4
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

patents stripe