CID 4912907

(4-aminophenyl)(1-methyl-1h-imidazol-2-yl)methanol

Structural Information

Molecular Formula
C11H13N3O
SMILES
CN1C=CN=C1C(C2=CC=C(C=C2)N)O
InChI
InChI=1S/C11H13N3O/c1-14-7-6-13-11(14)10(15)8-2-4-9(12)5-3-8/h2-7,10,15H,12H2,1H3
InChIKey
LRLMBYIRRCQVAM-UHFFFAOYSA-N
Compound name
(4-aminophenyl)-(1-methylimidazol-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

203.10587 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.113146 144.4
[M+Na]+ 226.095088 152.5
[M-H]- 202.098594 147.4
[M+NH4]+ 221.139693 161.4
[M+K]+ 242.069028 148.9
[M+H-H2O]+ 186.103130 136.5
[M+HCOO]- 248.104071 166.1
[M+CH3COO]- 262.119721 185.1
[M+Na-2H]- 224.080536 147.9
[M]+ 203.10532142 142.3
[M]- 203.10641858 142.3
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