CID 6410585

Hl 2185

Structural Information

Molecular Formula
C19H21N3O
SMILES
CN(C)CCOC1=NN=C(C2=CC=CC=C21)CC3=CC=CC=C3
InChI
InChI=1S/C19H21N3O/c1-22(2)12-13-23-19-17-11-7-6-10-16(17)18(20-21-19)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3
InChIKey
CQEZYPMWFUYVEM-UHFFFAOYSA-N
Compound name
2-(4-benzylphthalazin-1-yl)oxy-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.16846 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.17574 174.1
[M+Na]+ 330.15768 189.8
[M+NH4]+ 325.20228 182.7
[M+K]+ 346.13162 180.6
[M-H]- 306.16118 179.7
[M+Na-2H]- 328.14313 184.1
[M]+ 307.16791 178.1
[M]- 307.16901 178.1
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.