CID 60860780

773019-75-3

Structural Information

Molecular Formula
C11H13N3O
SMILES
COC1=CC=C(C=C1)CN2C=CN=C2N
InChI
InChI=1S/C11H13N3O/c1-15-10-4-2-9(3-5-10)8-14-7-6-13-11(14)12/h2-7H,8H2,1H3,(H2,12,13)
InChIKey
QITMWFGOHWCWPU-UHFFFAOYSA-N
Compound name
1-[(4-methoxyphenyl)methyl]imidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.10587 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.11315 143.4
[M+Na]+ 226.09509 152.2
[M-H]- 202.09859 147.6
[M+NH4]+ 221.13969 161.2
[M+K]+ 242.06903 149.0
[M+H-H2O]+ 186.10313 135.0
[M+HCOO]- 248.10407 167.6
[M+CH3COO]- 262.11972 186.7
[M+Na-2H]- 224.08054 148.6
[M]+ 203.10532 143.8
[M]- 203.10642 143.8
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.