CID 762721

1-[2-(3-methoxyphenoxy)ethyl]piperazine

Structural Information

Molecular Formula
C13H20N2O2
SMILES
COC1=CC(=CC=C1)OCCN2CCNCC2
InChI
InChI=1S/C13H20N2O2/c1-16-12-3-2-4-13(11-12)17-10-9-15-7-5-14-6-8-15/h2-4,11,14H,5-10H2,1H3
InChIKey
RKKDHOAVZQZXCE-UHFFFAOYSA-N
Compound name
1-[2-(3-methoxyphenoxy)ethyl]piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

236.15248 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.15976 155.7
[M+Na]+ 259.14170 159.9
[M-H]- 235.14520 156.9
[M+NH4]+ 254.18630 169.4
[M+K]+ 275.11564 156.7
[M+H-H2O]+ 219.14974 146.5
[M+HCOO]- 281.15068 172.3
[M+CH3COO]- 295.16633 188.0
[M+Na-2H]- 257.12715 160.1
[M]+ 236.15193 152.4
[M]- 236.15303 152.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe