CID 64834611

1-benzyl-3-cyclopropylpiperazine

Structural Information

Molecular Formula
C14H20N2
SMILES
C1CC1C2CN(CCN2)CC3=CC=CC=C3
InChI
InChI=1S/C14H20N2/c1-2-4-12(5-3-1)10-16-9-8-15-14(11-16)13-6-7-13/h1-5,13-15H,6-11H2
InChIKey
VRHIEXKAIFVDFY-UHFFFAOYSA-N
Compound name
1-benzyl-3-cyclopropylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.16264 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.16992 154.0
[M+Na]+ 239.15186 160.1
[M-H]- 215.15536 159.0
[M+NH4]+ 234.19646 164.0
[M+K]+ 255.12580 155.1
[M+H-H2O]+ 199.15990 144.7
[M+HCOO]- 261.16084 170.9
[M+CH3COO]- 275.17649 163.8
[M+Na-2H]- 237.13731 158.1
[M]+ 216.16209 149.4
[M]- 216.16319 149.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.