CID 81204

6709-58-6

Structural Information

Molecular Formula
C14H10Cl2N5O4
SMILES
COC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)OC)[N+]#N
InChI
InChI=1S/C14H10Cl2N5O4/c1-24-12-6-11(13(25-2)5-10(12)18-17)19-20-14-8(15)3-7(21(22)23)4-9(14)16/h3-6H,1-2H3/q+1
InChIKey
VTOWZOJOEIGNGU-UHFFFAOYSA-N
Compound name
4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-2,5-dimethoxybenzenediazonium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

382.011 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.01828 194.7
[M+Na]+ 405.00022 204.4
[M-H]- 381.00372 202.3
[M+NH4]+ 400.04482 205.7
[M+K]+ 420.97416 192.4
[M+H-H2O]+ 365.00826 187.3
[M+HCOO]- 427.00920 212.5
[M+CH3COO]- 441.02485 225.9
[M+Na-2H]- 402.98567 200.1
[M]+ 382.01045 195.4
[M]- 382.01155 195.4
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

patents stripe