CID 20428339

1-phenyl-1,2,3,4-tetrahydroquinoxaline

Structural Information

Molecular Formula
C14H14N2
SMILES
C1CN(C2=CC=CC=C2N1)C3=CC=CC=C3
InChI
InChI=1S/C14H14N2/c1-2-6-12(7-3-1)16-11-10-15-13-8-4-5-9-14(13)16/h1-9,15H,10-11H2
InChIKey
VGNRZXNRCPQLBD-UHFFFAOYSA-N
Compound name
4-phenyl-2,3-dihydro-1H-quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

210.11569 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.12297 148.1
[M+Na]+ 233.10491 163.7
[M+NH4]+ 228.14951 158.0
[M+K]+ 249.07885 154.7
[M-H]- 209.10841 152.9
[M+Na-2H]- 231.09036 157.8
[M]+ 210.11514 151.8
[M]- 210.11624 151.8
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