CID 2736205

1-(3,5-dimethoxyphenyl)piperazine

Structural Information

Molecular Formula
C12H18N2O2
SMILES
COC1=CC(=CC(=C1)N2CCNCC2)OC
InChI
InChI=1S/C12H18N2O2/c1-15-11-7-10(8-12(9-11)16-2)14-5-3-13-4-6-14/h7-9,13H,3-6H2,1-2H3
InChIKey
COWMQOCYJSUFSB-UHFFFAOYSA-N
Compound name
1-(3,5-dimethoxyphenyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

572
Patents

222.13683 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.14411 151.8
[M+Na]+ 245.12605 164.2
[M+NH4]+ 240.17065 159.4
[M+K]+ 261.09999 157.7
[M-H]- 221.12955 154.3
[M+Na-2H]- 243.11150 158.4
[M]+ 222.13628 154.1
[M]- 222.13738 154.1
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

patents stripe