CID 3046676

62537-66-0

Structural Information

Molecular Formula
C14H19N3O
SMILES
CCN(CC)C1=NC2=CC=CC=C2NC(=O)C1C
InChI
InChI=1S/C14H19N3O/c1-4-17(5-2)13-10(3)14(18)16-12-9-7-6-8-11(12)15-13/h6-10H,4-5H2,1-3H3,(H,16,18)
InChIKey
DIIIXLFPJOLREQ-UHFFFAOYSA-N
Compound name
4-(diethylamino)-3-methyl-1,3-dihydro-1,5-benzodiazepin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.15282 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.16010 155.1
[M+Na]+ 268.14204 165.5
[M+NH4]+ 263.18664 161.8
[M+K]+ 284.11598 160.7
[M-H]- 244.14554 156.6
[M+Na-2H]- 266.12749 160.2
[M]+ 245.15227 156.9
[M]- 245.15337 156.9
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.