CID 336077

22776-58-5

Structural Information

Molecular Formula
C19H17NO
SMILES
CC1(CC2=C(C3=CC=CC=C31)NC4=CC=CC=C4C2=O)C
InChI
InChI=1S/C19H17NO/c1-19(2)11-14-17(12-7-3-5-9-15(12)19)20-16-10-6-4-8-13(16)18(14)21/h3-10H,11H2,1-2H3,(H,20,21)
InChIKey
VYMUQJAMVNVXAJ-UHFFFAOYSA-N
Compound name
5,5-dimethyl-6,12-dihydrobenzo[c]acridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.131 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.138276 164.1
[M+Na]+ 298.120218 174.7
[M-H]- 274.123724 168.1
[M+NH4]+ 293.164823 183.6
[M+K]+ 314.094158 167.4
[M+H-H2O]+ 258.128260 155.4
[M+HCOO]- 320.129201 180.5
[M+CH3COO]- 334.144851 175.6
[M+Na-2H]- 296.105666 172.5
[M]+ 275.13045142 163.2
[M]- 275.13154858 163.2
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.