CID 23151525

(4-tert-butyl-1h-imidazol-2-yl)methanol hydrochloride

Structural Information

Molecular Formula
C8H14N2O
SMILES
CC(C)(C)C1=CN=C(N1)CO
InChI
InChI=1S/C8H14N2O/c1-8(2,3)6-4-9-7(5-11)10-6/h4,11H,5H2,1-3H3,(H,9,10)
InChIKey
AUCMBAVDQOMUBB-UHFFFAOYSA-N
Compound name
(5-tert-butyl-1H-imidazol-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

154.11061 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.11789 135.6
[M+Na]+ 177.09983 144.0
[M-H]- 153.10333 134.3
[M+NH4]+ 172.14443 155.0
[M+K]+ 193.07377 141.6
[M+H-H2O]+ 137.10787 129.9
[M+HCOO]- 199.10881 154.3
[M+CH3COO]- 213.12446 171.3
[M+Na-2H]- 175.08528 140.9
[M]+ 154.11006 134.3
[M]- 154.11116 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