CID 102522

930-61-0

Structural Information

Molecular Formula
C5H10N2
SMILES
CC1CN=C(N1)C
InChI
InChI=1S/C5H10N2/c1-4-3-6-5(2)7-4/h4H,3H2,1-2H3,(H,6,7)
InChIKey
DIHAURBCYGTGCV-UHFFFAOYSA-N
Compound name
2,5-dimethyl-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2390
Patents

98.0844 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.091676 119.0
[M+Na]+ 121.07362 127.6
[M-H]- 97.077124 118.7
[M+NH4]+ 116.11822 141.1
[M+K]+ 137.04756 126.3
[M+H-H2O]+ 81.081660 113.0
[M+HCOO]- 143.08260 140.0
[M+CH3COO]- 157.09825 163.6
[M+Na-2H]- 119.05907 124.7
[M]+ 98.083851 116.2
[M]- 98.084949 116.2
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