CID 3059991

77562-84-6

Structural Information

Molecular Formula
C15H25N3
SMILES
CCC1CN(CCN1C2=CC=CC=C2)CC(C)N
InChI
InChI=1S/C15H25N3/c1-3-14-12-17(11-13(2)16)9-10-18(14)15-7-5-4-6-8-15/h4-8,13-14H,3,9-12,16H2,1-2H3
InChIKey
CYUAEUWBLKMBHK-UHFFFAOYSA-N
Compound name
1-(3-ethyl-4-phenylpiperazin-1-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.20485 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.212126 162.7
[M+Na]+ 270.194068 166.6
[M-H]- 246.197574 165.0
[M+NH4]+ 265.238673 176.6
[M+K]+ 286.168008 162.7
[M+H-H2O]+ 230.202110 153.4
[M+HCOO]- 292.203051 179.1
[M+CH3COO]- 306.218701 198.7
[M+Na-2H]- 268.179516 164.0
[M]+ 247.20430142 157.3
[M]- 247.20539858 157.3
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.