CID 1346

1-(2-methoxyphenyl)piperazine

Structural Information

Molecular Formula
C11H16N2O
SMILES
COC1=CC=CC=C1N2CCNCC2
InChI
InChI=1S/C11H16N2O/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
InChIKey
VNZLQLYBRIOLFZ-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenyl)piperazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

113
References

4877
Patents

192.12627 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.13355 143.9
[M+Na]+ 215.11549 149.1
[M-H]- 191.11899 145.5
[M+NH4]+ 210.16009 159.5
[M+K]+ 231.08943 145.9
[M+H-H2O]+ 175.12353 135.4
[M+HCOO]- 237.12447 161.0
[M+CH3COO]- 251.14012 179.9
[M+Na-2H]- 213.10094 149.3
[M]+ 192.12572 138.5
[M]- 192.12682 138.5
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