CID 9574978

3-furancarboxamide, n-[[4-chloro-3-(dimethylhydrazono)methyl]phenyl]-2-methyl

Structural Information

Molecular Formula
C15H16ClN3O2
SMILES
CC1=C(C=CO1)C(=O)NC2=CC(=C(C=C2)Cl)/C=N/N(C)C
InChI
InChI=1S/C15H16ClN3O2/c1-10-13(6-7-21-10)15(20)18-12-4-5-14(16)11(8-12)9-17-19(2)3/h4-9H,1-3H3,(H,18,20)/b17-9+
InChIKey
UMWPVUFGDYGEPG-RQZCQDPDSA-N
Compound name
N-[4-chloro-3-[(E)-(dimethylhydrazinylidene)methyl]phenyl]-2-methylfuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.0931 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.10038 174.6
[M+Na]+ 328.08232 182.5
[M-H]- 304.08582 185.2
[M+NH4]+ 323.12692 191.5
[M+K]+ 344.05626 180.1
[M+H-H2O]+ 288.09036 167.1
[M+HCOO]- 350.09130 198.6
[M+CH3COO]- 364.10695 214.9
[M+Na-2H]- 326.06777 177.1
[M]+ 305.09255 180.4
[M]- 305.09365 180.4
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.