CID 64678697

2-methyl-4-(4-phenylpiperazin-1-yl)butan-2-amine

Structural Information

Molecular Formula
C15H25N3
SMILES
CC(C)(CCN1CCN(CC1)C2=CC=CC=C2)N
InChI
InChI=1S/C15H25N3/c1-15(2,16)8-9-17-10-12-18(13-11-17)14-6-4-3-5-7-14/h3-7H,8-13,16H2,1-2H3
InChIKey
OUXJQMXQYFBOKL-UHFFFAOYSA-N
Compound name
2-methyl-4-(4-phenylpiperazin-1-yl)butan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.20485 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.21213 162.6
[M+Na]+ 270.19407 166.2
[M-H]- 246.19757 164.7
[M+NH4]+ 265.23867 176.3
[M+K]+ 286.16801 162.3
[M+H-H2O]+ 230.20211 153.5
[M+HCOO]- 292.20305 178.4
[M+CH3COO]- 306.21870 197.1
[M+Na-2H]- 268.17952 166.5
[M]+ 247.20430 156.9
[M]- 247.20540 156.9
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.