CID 457180

2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-n-[1-(hydrazinecarbonyl)-2-methyl-propyl]acetamide

Structural Information

Molecular Formula
C15H20Cl2N4O4
SMILES
CC(C)C(C(=O)NN)NC(=O)CNC(=O)COC1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C15H20Cl2N4O4/c1-8(2)14(15(24)21-18)20-12(22)6-19-13(23)7-25-11-4-3-9(16)5-10(11)17/h3-5,8,14H,6-7,18H2,1-2H3,(H,19,23)(H,20,22)(H,21,24)
InChIKey
BCDPCKAFXBOZHG-UHFFFAOYSA-N
Compound name
2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

390.08615 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.09343 189.0
[M+Na]+ 413.07537 192.8
[M-H]- 389.07887 191.4
[M+NH4]+ 408.11997 200.2
[M+K]+ 429.04931 189.6
[M+H-H2O]+ 373.08341 183.4
[M+HCOO]- 435.08435 202.4
[M+CH3COO]- 449.10000 227.8
[M+Na-2H]- 411.06082 186.0
[M]+ 390.08560 191.8
[M]- 390.08670 191.8
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.