CID 610682

2-(naphthalen-2-ylmethyl)-4,5-dihydro-1h-imidazole

Structural Information

Molecular Formula
C14H14N2
SMILES
C1CN=C(N1)CC2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C14H14N2/c1-2-4-13-9-11(5-6-12(13)3-1)10-14-15-7-8-16-14/h1-6,9H,7-8,10H2,(H,15,16)
InChIKey
VIXRKFBKWOHVBR-UHFFFAOYSA-N
Compound name
2-(naphthalen-2-ylmethyl)-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

15
Patents

210.11569 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.12297 146.6
[M+Na]+ 233.10491 154.2
[M-H]- 209.10841 149.9
[M+NH4]+ 228.14951 164.6
[M+K]+ 249.07885 148.6
[M+H-H2O]+ 193.11295 138.2
[M+HCOO]- 255.11389 166.1
[M+CH3COO]- 269.12954 158.5
[M+Na-2H]- 231.09036 152.8
[M]+ 210.11514 143.4
[M]- 210.11624 143.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe