CID 2736204

1-(2,4-dimethoxyphenyl)piperazine

Structural Information

Molecular Formula
C12H18N2O2
SMILES
COC1=CC(=C(C=C1)N2CCNCC2)OC
InChI
InChI=1S/C12H18N2O2/c1-15-10-3-4-11(12(9-10)16-2)14-7-5-13-6-8-14/h3-4,9,13H,5-8H2,1-2H3
InChIKey
XZXCBTBAADXWDD-UHFFFAOYSA-N
Compound name
1-(2,4-dimethoxyphenyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

580
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 151.5
[M+Na]+ 245.12605 157.2
[M-H]- 221.12955 153.4
[M+NH4]+ 240.17065 166.2
[M+K]+ 261.09999 154.3
[M+H-H2O]+ 205.13409 142.9
[M+HCOO]- 267.13503 168.5
[M+CH3COO]- 281.15068 186.2
[M+Na-2H]- 243.11150 155.7
[M]+ 222.13628 148.3
[M]- 222.13738 148.3
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