CID 275938

2,3,5,6-tetraphenylpyrazine

Structural Information

Molecular Formula
C28H20N2
SMILES
C1=CC=C(C=C1)C2=C(N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C28H20N2/c1-5-13-21(14-6-1)25-26(22-15-7-2-8-16-22)30-28(24-19-11-4-12-20-24)27(29-25)23-17-9-3-10-18-23/h1-20H
InChIKey
ZPKCJXWKXAHCSX-UHFFFAOYSA-N
Compound name
2,3,5,6-tetraphenylpyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

977
Patents

384.16266 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.16994 197.9
[M+Na]+ 407.15188 204.5
[M-H]- 383.15538 209.5
[M+NH4]+ 402.19648 204.5
[M+K]+ 423.12582 194.8
[M+H-H2O]+ 367.15992 183.5
[M+HCOO]- 429.16086 217.2
[M+CH3COO]- 443.17651 206.3
[M+Na-2H]- 405.13733 202.8
[M]+ 384.16211 194.6
[M]- 384.16321 194.6
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