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]+ 193.108376 140.8
[M+Na]+ 215.090318 147.0
[M-H]- 191.093824 148.4
[M+NH4]+ 210.134923 160.8
[M+K]+ 231.064258 147.8
[M+H-H2O]+ 175.098360 132.9
[M+HCOO]- 237.099301 171.9
[M+CH3COO]- 251.114951 200.8
[M+Na-2H]- 213.075766 147.3
[M]+ 192.10055142 141.4
[M]- 192.10164858 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.