CID 90105

23456-93-1

Structural Information

Molecular Formula
C8H10IN3
SMILES
CN(C)N=NC1=CC=C(C=C1)I
InChI
InChI=1S/C8H10IN3/c1-12(2)11-10-8-5-3-7(9)4-6-8/h3-6H,1-2H3
InChIKey
YONGWAYQQVMIBR-UHFFFAOYSA-N
Compound name
N-[(4-iodophenyl)diazenyl]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

274.99194 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.99922 147.5
[M+Na]+ 297.98116 147.6
[M-H]- 273.98466 148.2
[M+NH4]+ 293.02576 164.1
[M+K]+ 313.95510 153.8
[M+H-H2O]+ 257.98920 136.5
[M+HCOO]- 319.99014 173.0
[M+CH3COO]- 334.00579 202.0
[M+Na-2H]- 295.96661 143.3
[M]+ 274.99139 146.7
[M]- 274.99249 146.7
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

No patent data available for this compound.