CID 9589108

Brn 4824274

Structural Information

Molecular Formula
C18H21N5O3
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)C(=O)NNC2=CC=C(C=C2)OC
InChI
InChI=1S/C18H21N5O3/c1-23(2)15-8-4-13(5-9-15)12-19-21-17(24)18(25)22-20-14-6-10-16(26-3)11-7-14/h4-12,20H,1-3H3,(H,21,24)(H,22,25)/b19-12+
InChIKey
GAXDAALIOWBJJN-XDHOZWIPSA-N
Compound name
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-2-[2-(4-methoxyphenyl)hydrazinyl]-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.16443 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.17171 183.7
[M+Na]+ 378.15365 186.7
[M-H]- 354.15715 192.8
[M+NH4]+ 373.19825 195.8
[M+K]+ 394.12759 185.9
[M+H-H2O]+ 338.16169 173.2
[M+HCOO]- 400.16263 212.8
[M+CH3COO]- 414.17828 230.8
[M+Na-2H]- 376.13910 187.7
[M]+ 355.16388 185.0
[M]- 355.16498 185.0
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.