CID 52816

73941-41-0

Structural Information

Molecular Formula
C13H20N2
SMILES
CCN1CCN(C1C2=CC=CC=C2)CC
InChI
InChI=1S/C13H20N2/c1-3-14-10-11-15(4-2)13(14)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3
InChIKey
WVKVIIZOIXEUDN-UHFFFAOYSA-N
Compound name
1,3-diethyl-2-phenylimidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

204.16264 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.169916 148.7
[M+Na]+ 227.151858 155.5
[M-H]- 203.155364 152.2
[M+NH4]+ 222.196463 167.0
[M+K]+ 243.125798 152.3
[M+H-H2O]+ 187.159900 140.4
[M+HCOO]- 249.160841 168.7
[M+CH3COO]- 263.176491 187.3
[M+Na-2H]- 225.137306 151.1
[M]+ 204.16209142 147.1
[M]- 204.16318858 147.1
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

patents stripe