CID 93116

Benzenediazonium, 4-(benzoylamino)-2,5-dimethoxy-

Structural Information

Molecular Formula
C15H14N3O3
SMILES
COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)[N+]#N
InChI
InChI=1S/C15H13N3O3/c1-20-13-9-12(18-16)14(21-2)8-11(13)17-15(19)10-6-4-3-5-7-10/h3-9H,1-2H3/p+1
InChIKey
KBYWCGCRACQITA-UHFFFAOYSA-O
Compound name
4-benzamido-2,5-dimethoxybenzenediazonium
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

3
References

335
Patents

284.10352 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.11080 170.6
[M+Na]+ 307.09274 179.6
[M-H]- 283.09624 177.5
[M+NH4]+ 302.13734 184.1
[M+K]+ 323.06668 171.5
[M+H-H2O]+ 267.10078 158.1
[M+HCOO]- 329.10172 193.0
[M+CH3COO]- 343.11737 210.9
[M+Na-2H]- 305.07819 176.6
[M]+ 284.10297 167.3
[M]- 284.10407 167.3
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