CID 135449330

Cbs 1276

Structural Information

Molecular Formula
C11H14N4O
SMILES
CC1=C(C=CC(=C1)O)/C=N/NC2=NCCN2
InChI
InChI=1S/C11H14N4O/c1-8-6-10(16)3-2-9(8)7-14-15-11-12-4-5-13-11/h2-3,6-7,16H,4-5H2,1H3,(H2,12,13,15)/b14-7+
InChIKey
DBFDJRMPJGXVPU-VGOFMYFVSA-N
Compound name
4-[(E)-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)methyl]-3-methylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

218.11676 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.12404 147.7
[M+Na]+ 241.10598 154.6
[M-H]- 217.10948 150.7
[M+NH4]+ 236.15058 164.1
[M+K]+ 257.07992 150.4
[M+H-H2O]+ 201.11402 139.2
[M+HCOO]- 263.11496 170.9
[M+CH3COO]- 277.13061 188.1
[M+Na-2H]- 239.09143 153.0
[M]+ 218.11621 144.2
[M]- 218.11731 144.2
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.