CID 2741385

Ethyl 4-(2-methoxyphenyl)piperazine-1-carboxylate

Structural Information

Molecular Formula
C14H20N2O3
SMILES
CCOC(=O)N1CCN(CC1)C2=CC=CC=C2OC
InChI
InChI=1S/C14H20N2O3/c1-3-19-14(17)16-10-8-15(9-11-16)12-6-4-5-7-13(12)18-2/h4-7H,3,8-11H2,1-2H3
InChIKey
YFDOAOHRTFGTEU-UHFFFAOYSA-N
Compound name
ethyl 4-(2-methoxyphenyl)piperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

4
Patents

264.1474 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.154676 162.1
[M+Na]+ 287.136618 167.4
[M-H]- 263.140124 165.2
[M+NH4]+ 282.181223 175.7
[M+K]+ 303.110558 165.4
[M+H-H2O]+ 247.144660 152.8
[M+HCOO]- 309.145601 179.3
[M+CH3COO]- 323.161251 195.5
[M+Na-2H]- 285.122066 164.6
[M]+ 264.14685142 161.4
[M]- 264.14794858 161.4
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