CID 362864

Nsc627270

Structural Information

Molecular Formula
C17H13NO
SMILES
C1CC2=C(C3=CC=CC=C31)NC(=O)C4=CC=CC=C24
InChI
InChI=1S/C17H13NO/c19-17-15-8-4-3-7-13(15)14-10-9-11-5-1-2-6-12(11)16(14)18-17/h1-8H,9-10H2,(H,18,19)
InChIKey
AMAXBIKMKZRFCE-UHFFFAOYSA-N
Compound name
11,12-dihydro-5H-benzo[c]phenanthridin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

247.09972 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.10700 152.6
[M+Na]+ 270.08894 162.1
[M-H]- 246.09244 156.3
[M+NH4]+ 265.13354 170.9
[M+K]+ 286.06288 155.1
[M+H-H2O]+ 230.09698 144.4
[M+HCOO]- 292.09792 169.8
[M+CH3COO]- 306.11357 164.3
[M+Na-2H]- 268.07439 162.2
[M]+ 247.09917 150.4
[M]- 247.10027 150.4
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