CID 27393

Brn 2667232

Structural Information

Molecular Formula
C17H19N3O2
SMILES
C1=CC=C(C=C1)CNC(=O)CCNNC(=O)C2=CC=CC=C2
InChI
InChI=1S/C17H19N3O2/c21-16(18-13-14-7-3-1-4-8-14)11-12-19-20-17(22)15-9-5-2-6-10-15/h1-10,19H,11-13H2,(H,18,21)(H,20,22)
InChIKey
BUVVXNBXBFQRHS-UHFFFAOYSA-N
Compound name
3-(2-benzoylhydrazinyl)-N-benzylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.14774 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.15502 168.9
[M+Na]+ 320.13696 171.5
[M-H]- 296.14046 174.6
[M+NH4]+ 315.18156 182.2
[M+K]+ 336.11090 167.9
[M+H-H2O]+ 280.14500 159.7
[M+HCOO]- 342.14594 194.2
[M+CH3COO]- 356.16159 209.0
[M+Na-2H]- 318.12241 174.3
[M]+ 297.14719 166.9
[M]- 297.14829 166.9
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

patents stripe