CID 219966

5,6-dihydrophenanthridine hydrochloride

Structural Information

Molecular Formula
C13H11N
SMILES
C1C2=CC=CC=C2C3=CC=CC=C3N1
InChI
InChI=1S/C13H11N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-8,14H,9H2
InChIKey
YQQRKUQVFWYEPV-UHFFFAOYSA-N
Compound name
5,6-dihydrophenanthridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

596
Patents

181.08914 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.09642 138.0
[M+Na]+ 204.07836 154.0
[M+NH4]+ 199.12296 149.1
[M+K]+ 220.05230 144.7
[M-H]- 180.08186 142.3
[M+Na-2H]- 202.06381 146.7
[M]+ 181.08859 141.7
[M]- 181.08969 141.7
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