CID 3054681

71576-66-4

Structural Information

Molecular Formula
C15H21N3
SMILES
C1CCC(CC1)C2=CC=C(C=C2)NC3=NCCN3
InChI
InChI=1S/C15H21N3/c1-2-4-12(5-3-1)13-6-8-14(9-7-13)18-15-16-10-11-17-15/h6-9,12H,1-5,10-11H2,(H2,16,17,18)
InChIKey
DNWWODFFEFZASF-UHFFFAOYSA-N
Compound name
N-(4-cyclohexylphenyl)-4,5-dihydro-1H-imidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

243.17355 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.18083 156.8
[M+Na]+ 266.16277 159.8
[M-H]- 242.16627 161.2
[M+NH4]+ 261.20737 171.5
[M+K]+ 282.13671 154.7
[M+H-H2O]+ 226.17081 147.0
[M+HCOO]- 288.17175 174.2
[M+CH3COO]- 302.18740 166.3
[M+Na-2H]- 264.14822 159.4
[M]+ 243.17300 147.5
[M]- 243.17410 147.5
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