CID 54923632

N-methyl-1-(4-methylphthalazin-1-yl)piperidin-4-amine

Structural Information

Molecular Formula
C15H20N4
SMILES
CC1=NN=C(C2=CC=CC=C12)N3CCC(CC3)NC
InChI
InChI=1S/C15H20N4/c1-11-13-5-3-4-6-14(13)15(18-17-11)19-9-7-12(16-2)8-10-19/h3-6,12,16H,7-10H2,1-2H3
InChIKey
KSBKWOUOYRKCOG-UHFFFAOYSA-N
Compound name
N-methyl-1-(4-methylphthalazin-1-yl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.1688 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.17608 162.2
[M+Na]+ 279.15802 168.7
[M-H]- 255.16152 164.9
[M+NH4]+ 274.20262 175.6
[M+K]+ 295.13196 163.5
[M+H-H2O]+ 239.16606 151.7
[M+HCOO]- 301.16700 178.6
[M+CH3COO]- 315.18265 172.1
[M+Na-2H]- 277.14347 168.1
[M]+ 256.16825 158.0
[M]- 256.16935 158.0
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.