CID 6444897

Brn 2915224

Structural Information

Molecular Formula
C22H27N5O3
SMILES
CCN(CC)C1=CC=C(C=C1)/C=C(/C(=O)NN)\NC(=O)C2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C22H27N5O3/c1-4-27(5-2)19-12-6-16(7-13-19)14-20(22(30)26-23)25-21(29)17-8-10-18(11-9-17)24-15(3)28/h6-14H,4-5,23H2,1-3H3,(H,24,28)(H,25,29)(H,26,30)/b20-14-
InChIKey
DITYAWHMGNYIKZ-ZHZULCJRSA-N
Compound name
4-acetamido-N-[(Z)-1-[4-(diethylamino)phenyl]-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.2114 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.21868 201.6
[M+Na]+ 432.20062 207.2
[M+NH4]+ 427.24522 204.8
[M+K]+ 448.17456 203.4
[M-H]- 408.20412 205.3
[M+Na-2H]- 430.18607 205.6
[M]+ 409.21085 202.6
[M]- 409.21195 202.6
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.