CID 207714

Brn 0624565

Structural Information

Molecular Formula
C17H20N4O
SMILES
CC1=NC2=C(C=C1)C(=O)N(C3=CC=CC=C3N2)CCN(C)C
InChI
InChI=1S/C17H20N4O/c1-12-8-9-13-16(18-12)19-14-6-4-5-7-15(14)21(17(13)22)11-10-20(2)3/h4-9H,10-11H2,1-3H3,(H,18,19)
InChIKey
ZFLYKXWKMDFRIM-UHFFFAOYSA-N
Compound name
6-[2-(dimethylamino)ethyl]-2-methyl-11H-pyrido[3,2-c][1,5]benzodiazepin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.1637 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.17098 169.4
[M+Na]+ 319.15292 181.1
[M+NH4]+ 314.19752 175.9
[M+K]+ 335.12686 175.4
[M-H]- 295.15642 171.2
[M+Na-2H]- 317.13837 174.2
[M]+ 296.16315 171.5
[M]- 296.16425 171.5
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.