CID 3065918

2,5-dimethyl-1-tetradecylpiperazine dihydrochloride

Structural Information

Molecular Formula
C20H42N2
SMILES
CCCCCCCCCCCCCCN1CC(NCC1C)C
InChI
InChI=1S/C20H42N2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-22-18-19(2)21-17-20(22)3/h19-21H,4-18H2,1-3H3
InChIKey
XUVMGULPJCTBGE-UHFFFAOYSA-N
Compound name
2,5-dimethyl-1-tetradecylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

310.3348 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.34208 187.7
[M+Na]+ 333.32402 188.8
[M-H]- 309.32752 184.3
[M+NH4]+ 328.36862 199.5
[M+K]+ 349.29796 183.7
[M+H-H2O]+ 293.33206 178.7
[M+HCOO]- 355.33300 200.0
[M+CH3COO]- 369.34865 210.5
[M+Na-2H]- 331.30947 185.1
[M]+ 310.33425 187.2
[M]- 310.33535 187.2
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.