CID 57356075

Ns00065335

Structural Information

Molecular Formula
C24H51N3
SMILES
CCCCCCCCCCCCCCCCCC1N(CCN1CCN)CC
InChI
InChI=1S/C24H51N3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-26(4-2)22-23-27(24)21-20-25/h24H,3-23,25H2,1-2H3
InChIKey
XCKRQSNPAFCNLH-UHFFFAOYSA-N
Compound name
2-(3-ethyl-2-heptadecylimidazolidin-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.4083 Da
Monoisotopic Mass

8.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.415576 207.7
[M+Na]+ 404.397518 207.4
[M-H]- 380.401024 204.7
[M+NH4]+ 399.442123 218.5
[M+K]+ 420.371458 202.0
[M+H-H2O]+ 364.405560 197.5
[M+HCOO]- 426.406501 222.8
[M+CH3COO]- 440.422151 228.8
[M+Na-2H]- 402.382966 201.6
[M]+ 381.40775142 210.9
[M]- 381.40884858 210.9
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.