CID 3023490

Ns00064364

Structural Information

Molecular Formula
C20H34N2
SMILES
CCCCCCCCCCN1CCN(C1)CC2=CC=CC=C2
InChI
InChI=1S/C20H34N2/c1-2-3-4-5-6-7-8-12-15-21-16-17-22(19-21)18-20-13-10-9-11-14-20/h9-11,13-14H,2-8,12,15-19H2,1H3
InChIKey
LRUKHFQNTFSPFF-UHFFFAOYSA-N
Compound name
1-benzyl-3-decylimidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.2722 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.279476 180.2
[M+Na]+ 325.261418 182.9
[M-H]- 301.264924 181.9
[M+NH4]+ 320.306023 194.0
[M+K]+ 341.235358 177.9
[M+H-H2O]+ 285.269460 170.0
[M+HCOO]- 347.270401 197.7
[M+CH3COO]- 361.286051 207.1
[M+Na-2H]- 323.246866 179.5
[M]+ 302.27165142 180.6
[M]- 302.27274858 180.6
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.