CID 118303

36371-22-9

Structural Information

Molecular Formula
C16H25N3O
SMILES
CCN1CCN(C(C1)C(=O)NC2=CC=CC=C2C)CC
InChI
InChI=1S/C16H25N3O/c1-4-18-10-11-19(5-2)15(12-18)16(20)17-14-9-7-6-8-13(14)3/h6-9,15H,4-5,10-12H2,1-3H3,(H,17,20)
InChIKey
WFJVHNSQDCMXDX-UHFFFAOYSA-N
Compound name
1,4-diethyl-N-(2-methylphenyl)piperazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.19977 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.20705 169.0
[M+Na]+ 298.18899 173.7
[M-H]- 274.19249 172.1
[M+NH4]+ 293.23359 182.2
[M+K]+ 314.16293 169.9
[M+H-H2O]+ 258.19703 159.6
[M+HCOO]- 320.19797 186.2
[M+CH3COO]- 334.21362 204.2
[M+Na-2H]- 296.17444 170.1
[M]+ 275.19922 166.0
[M]- 275.20032 166.0
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

No patent data available for this compound.