CID 115499

63981-37-3

Structural Information

Molecular Formula
C20H33N3O
SMILES
CCCCN1CCN(C(C1)(C)C(=O)NC2=CC=CC=C2)CCCC
InChI
InChI=1S/C20H33N3O/c1-4-6-13-22-15-16-23(14-7-5-2)20(3,17-22)19(24)21-18-11-9-8-10-12-18/h8-12H,4-7,13-17H2,1-3H3,(H,21,24)
InChIKey
XDZCQRVRQJEPPA-UHFFFAOYSA-N
Compound name
1,4-dibutyl-2-methyl-N-phenylpiperazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.26236 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.26964 185.9
[M+Na]+ 354.25158 196.2
[M+NH4]+ 349.29618 193.6
[M+K]+ 370.22552 186.5
[M-H]- 330.25508 188.8
[M+Na-2H]- 352.23703 192.3
[M]+ 331.26181 188.1
[M]- 331.26291 188.1
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.