CID 4182372

35975-08-7

Structural Information

Molecular Formula
C22H18N2
SMILES
CN1C2=CC=CC=C2N(C3=C1C4=CC=CC=C4C5=CC=CC=C53)C
InChI
InChI=1S/C22H18N2/c1-23-19-13-7-8-14-20(19)24(2)22-18-12-6-4-10-16(18)15-9-3-5-11-17(15)21(22)23/h3-14H,1-2H3
InChIKey
CPTLVAUSBLXAIQ-UHFFFAOYSA-N
Compound name
9,14-dimethylphenanthro[9,10-b]quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

310.147 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.15428 175.4
[M+Na]+ 333.13622 186.5
[M-H]- 309.13972 180.0
[M+NH4]+ 328.18082 191.4
[M+K]+ 349.11016 178.1
[M+H-H2O]+ 293.14426 164.2
[M+HCOO]- 355.14520 191.1
[M+CH3COO]- 369.16085 186.0
[M+Na-2H]- 331.12167 184.3
[M]+ 310.14645 176.6
[M]- 310.14755 176.6
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