CID 14029873

2-pentadecyl-2,3-dihydro-1h-imidazole

Structural Information

Molecular Formula
C18H36N2
SMILES
CCCCCCCCCCCCCCCC1NC=CN1
InChI
InChI=1S/C18H36N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-19-16-17-20-18/h16-20H,2-15H2,1H3
InChIKey
BNSJFMWHZVTWGB-UHFFFAOYSA-N
Compound name
2-pentadecyl-2,3-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.28784 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.295116 177.5
[M+Na]+ 303.277058 179.0
[M-H]- 279.280564 173.0
[M+NH4]+ 298.321663 191.1
[M+K]+ 319.250998 173.5
[M+H-H2O]+ 263.285100 168.7
[M+HCOO]- 325.286041 192.7
[M+CH3COO]- 339.301691 199.0
[M+Na-2H]- 301.262506 176.5
[M]+ 280.28729142 177.2
[M]- 280.28838858 177.2
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.