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]+ 257.176076 162.2
[M+Na]+ 279.158018 168.7
[M-H]- 255.161524 164.9
[M+NH4]+ 274.202623 175.6
[M+K]+ 295.131958 163.5
[M+H-H2O]+ 239.166060 151.7
[M+HCOO]- 301.167001 178.6
[M+CH3COO]- 315.182651 172.1
[M+Na-2H]- 277.143466 168.1
[M]+ 256.16825142 158.0
[M]- 256.16934858 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.