CID 98546

1-ethyl-3-p-tolyltriazene

Structural Information

Molecular Formula
C9H13N3
SMILES
CCN=NNC1=CC=C(C=C1)C
InChI
InChI=1S/C9H13N3/c1-3-10-12-11-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,10,11)
InChIKey
BPOZIJBDYFHEJR-UHFFFAOYSA-N
Compound name
N-(ethyldiazenyl)-4-methylaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

420
Patents

163.11095 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.11823 135.3
[M+Na]+ 186.10017 146.9
[M+NH4]+ 181.14477 144.4
[M+K]+ 202.07411 139.5
[M-H]- 162.10367 140.2
[M+Na-2H]- 184.08562 143.9
[M]+ 163.11040 138.2
[M]- 163.11150 138.2
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

patents stripe