CID 93163

33330-91-5

Structural Information

Molecular Formula
C9H12N4O
SMILES
CN(C)N=NC1=CC=C(C=C1)C(=O)N
InChI
InChI=1S/C9H12N4O/c1-13(2)12-11-8-5-3-7(4-6-8)9(10)14/h3-6H,1-2H3,(H2,10,14)
InChIKey
NRVPCDAKWQWYRU-UHFFFAOYSA-N
Compound name
4-(dimethylaminodiazenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

192.1011 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.10838 140.8
[M+Na]+ 215.09032 147.0
[M-H]- 191.09382 148.4
[M+NH4]+ 210.13492 160.8
[M+K]+ 231.06426 147.8
[M+H-H2O]+ 175.09836 132.9
[M+HCOO]- 237.09930 171.9
[M+CH3COO]- 251.11495 200.8
[M+Na-2H]- 213.07577 147.3
[M]+ 192.10055 141.4
[M]- 192.10165 141.4
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.