CID 64012368

[2-(dimethylamino)-1-methyl-1h-imidazol-5-yl]methanol

Structural Information

Molecular Formula
C7H13N3O
SMILES
CN1C(=CN=C1N(C)C)CO
InChI
InChI=1S/C7H13N3O/c1-9(2)7-8-4-6(5-11)10(7)3/h4,11H,5H2,1-3H3
InChIKey
DMCUWLKGTYJBMZ-UHFFFAOYSA-N
Compound name
[2-(dimethylamino)-3-methylimidazol-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

155.10587 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.113146 132.5
[M+Na]+ 178.095088 141.5
[M-H]- 154.098594 134.2
[M+NH4]+ 173.139693 153.0
[M+K]+ 194.069028 141.0
[M+H-H2O]+ 138.103130 125.7
[M+HCOO]- 200.104071 156.2
[M+CH3COO]- 214.119721 180.7
[M+Na-2H]- 176.080536 137.2
[M]+ 155.10532142 134.3
[M]- 155.10641858 134.3
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