CID 208809

33048-49-6

Structural Information

Molecular Formula
C19H23N3O2
SMILES
CC1=C2CCC3=CC=CC=C3C2=NN(C1=O)CCN4CCOCC4
InChI
InChI=1S/C19H23N3O2/c1-14-16-7-6-15-4-2-3-5-17(15)18(16)20-22(19(14)23)9-8-21-10-12-24-13-11-21/h2-5H,6-13H2,1H3
InChIKey
UAUHAXHTAYLKEF-UHFFFAOYSA-N
Compound name
4-methyl-2-(2-morpholin-4-ylethyl)-5,6-dihydrobenzo[h]cinnolin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.17902 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.186296 180.1
[M+Na]+ 348.168238 186.9
[M-H]- 324.171744 183.8
[M+NH4]+ 343.212843 190.3
[M+K]+ 364.142178 181.9
[M+H-H2O]+ 308.176280 168.2
[M+HCOO]- 370.177221 191.6
[M+CH3COO]- 384.192871 188.7
[M+Na-2H]- 346.153686 184.5
[M]+ 325.17847142 177.9
[M]- 325.17956858 177.9
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.