CID 116815

Benzenamine, n,n-diethyl-3-methyl-4-(2-thiazolylazo)-

Structural Information

Molecular Formula
C14H18N4S
SMILES
CCN(CC)C1=CC(=C(C=C1)N=NC2=NC=CS2)C
InChI
InChI=1S/C14H18N4S/c1-4-18(5-2)12-6-7-13(11(3)10-12)16-17-14-15-8-9-19-14/h6-10H,4-5H2,1-3H3
InChIKey
KSBRYSDWPIMNEO-UHFFFAOYSA-N
Compound name
N,N-diethyl-3-methyl-4-(1,3-thiazol-2-yldiazenyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.1252 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.13248 163.2
[M+Na]+ 297.11442 170.9
[M-H]- 273.11792 173.2
[M+NH4]+ 292.15902 181.9
[M+K]+ 313.08836 168.5
[M+H-H2O]+ 257.12246 154.0
[M+HCOO]- 319.12340 188.6
[M+CH3COO]- 333.13905 212.2
[M+Na-2H]- 295.09987 166.0
[M]+ 274.12465 168.8
[M]- 274.12575 168.8
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.