CID 25219059

2-(7-methyl-1h-benzimidazol-2-yl)ethanol

Structural Information

Molecular Formula
C10H12N2O
SMILES
CC1=C2C(=CC=C1)NC(=N2)CCO
InChI
InChI=1S/C10H12N2O/c1-7-3-2-4-8-10(7)12-9(11-8)5-6-13/h2-4,13H,5-6H2,1H3,(H,11,12)
InChIKey
LPWDVWJTYGUIRO-UHFFFAOYSA-N
Compound name
2-(4-methyl-1H-benzimidazol-2-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.09496 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 136.6
[M+Na]+ 199.08418 147.1
[M-H]- 175.08768 136.6
[M+NH4]+ 194.12878 156.2
[M+K]+ 215.05812 142.5
[M+H-H2O]+ 159.09222 130.2
[M+HCOO]- 221.09316 157.6
[M+CH3COO]- 235.10881 149.8
[M+Na-2H]- 197.06963 143.5
[M]+ 176.09441 137.4
[M]- 176.09551 137.4
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

No patent data available for this compound.