CID 81430

1-(3-methoxyphenyl)piperazine

Structural Information

Molecular Formula
C11H16N2O
SMILES
COC1=CC=CC(=C1)N2CCNCC2
InChI
InChI=1S/C11H16N2O/c1-14-11-4-2-3-10(9-11)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
InChIKey
PZIBVWUXWNYTNL-UHFFFAOYSA-N
Compound name
1-(3-methoxyphenyl)piperazine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

1740
Patents

192.12627 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.133546 143.9
[M+Na]+ 215.115488 149.1
[M-H]- 191.118994 145.5
[M+NH4]+ 210.160093 159.5
[M+K]+ 231.089428 145.9
[M+H-H2O]+ 175.123530 135.4
[M+HCOO]- 237.124471 161.0
[M+CH3COO]- 251.140121 179.9
[M+Na-2H]- 213.100936 149.3
[M]+ 192.12572142 138.5
[M]- 192.12681858 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