CID 106205

67952-27-6

Structural Information

Molecular Formula
C11H16N3O
SMILES
CCN(CCO)C1=CC(=C(C=C1)[N+]#N)C
InChI
InChI=1S/C11H16N3O/c1-3-14(6-7-15)10-4-5-11(13-12)9(2)8-10/h4-5,8,15H,3,6-7H2,1-2H3/q+1
InChIKey
SXGIXDUUGJFLRI-UHFFFAOYSA-N
Compound name
4-[ethyl(2-hydroxyethyl)amino]-2-methylbenzenediazonium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.12933 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.13661 148.5
[M+Na]+ 229.11855 157.0
[M-H]- 205.12205 153.2
[M+NH4]+ 224.16315 165.5
[M+K]+ 245.09249 150.8
[M+H-H2O]+ 189.12659 137.8
[M+HCOO]- 251.12753 170.7
[M+CH3COO]- 265.14318 200.8
[M+Na-2H]- 227.10400 155.3
[M]+ 206.12878 144.4
[M]- 206.12988 144.4
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.