CID 9639522

N-(2-(2-(4-(dimethylamino)benzylidene)hydrazino)-2-oxoethyl)-4-methylbenzamide

Structural Information

Molecular Formula
C19H22N4O2
SMILES
CC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C19H22N4O2/c1-14-4-8-16(9-5-14)19(25)20-13-18(24)22-21-12-15-6-10-17(11-7-15)23(2)3/h4-12H,13H2,1-3H3,(H,20,25)(H,22,24)/b21-12+
InChIKey
DUDWPQVPMKWHMY-CIAFOILYSA-N
Compound name
N-[2-[(2E)-2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-2-oxoethyl]-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.1743 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.18158 182.5
[M+Na]+ 361.16352 186.1
[M-H]- 337.16702 191.5
[M+NH4]+ 356.20812 195.7
[M+K]+ 377.13746 184.1
[M+H-H2O]+ 321.17156 172.5
[M+HCOO]- 383.17250 210.2
[M+CH3COO]- 397.18815 226.9
[M+Na-2H]- 359.14897 185.3
[M]+ 338.17375 183.6
[M]- 338.17485 183.6
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.