CID 80283790

1-(1h-imidazol-2-yl)-2-methylpropan-1-ol hydrochloride

Structural Information

Molecular Formula
C7H12N2O
SMILES
CC(C)C(C1=NC=CN1)O
InChI
InChI=1S/C7H12N2O/c1-5(2)6(10)7-8-3-4-9-7/h3-6,10H,1-2H3,(H,8,9)
InChIKey
ZTUZTPIBFAGPCZ-UHFFFAOYSA-N
Compound name
1-(1H-imidazol-2-yl)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

140.09496 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.102236 131.1
[M+Na]+ 163.084178 137.9
[M-H]- 139.087684 129.3
[M+NH4]+ 158.128783 150.3
[M+K]+ 179.058118 136.3
[M+H-H2O]+ 123.092220 124.6
[M+HCOO]- 185.093161 149.6
[M+CH3COO]- 199.108811 169.2
[M+Na-2H]- 161.069626 134.4
[M]+ 140.09441142 128.4
[M]- 140.09550858 128.4
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