CID 2783977

2-butenedioic acid (z)-, mono((bis(4-(dimethylamino)phenyl)methylene)hydrazide)

Structural Information

Molecular Formula
C21H24N4O3
SMILES
CN(C)C1=CC=C(C=C1)C(=NNC(=O)/C=C\C(=O)O)C2=CC=C(C=C2)N(C)C
InChI
InChI=1S/C21H24N4O3/c1-24(2)17-9-5-15(6-10-17)21(23-22-19(26)13-14-20(27)28)16-7-11-18(12-8-16)25(3)4/h5-14H,1-4H3,(H,22,26)(H,27,28)/b14-13-
InChIKey
QHFBQCFFNVCRAG-YPKPFQOOSA-N
Compound name
(Z)-4-[2-[bis[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-4-oxobut-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.18484 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.19212 192.9
[M+Na]+ 403.17406 200.9
[M+NH4]+ 398.21866 197.3
[M+K]+ 419.14800 196.3
[M-H]- 379.17756 197.1
[M+Na-2H]- 401.15951 198.6
[M]+ 380.18429 194.6
[M]- 380.18539 194.6
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.