CID 256218

2,3-dihydro-5,6-diphenylpyrazine

Structural Information

Molecular Formula
C16H14N2
SMILES
C1CN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C16H14N2/c1-3-7-13(8-4-1)15-16(18-12-11-17-15)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey
RKLPQDGVFVQQOT-UHFFFAOYSA-N
Compound name
5,6-diphenyl-2,3-dihydropyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

27
Patents

234.11569 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.12297 153.3
[M+Na]+ 257.10491 160.3
[M-H]- 233.10841 159.7
[M+NH4]+ 252.14951 167.5
[M+K]+ 273.07885 154.7
[M+H-H2O]+ 217.11295 143.0
[M+HCOO]- 279.11389 174.1
[M+CH3COO]- 293.12954 164.8
[M+Na-2H]- 255.09036 161.1
[M]+ 234.11514 150.1
[M]- 234.11624 150.1
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

No patent data available for this compound.