CID 212229

23964-49-0

Structural Information

Molecular Formula
C14H18Cl2N2O2
SMILES
CC(C)COC1=C(C=C(C=C1Cl)C(=O)NN=C(C)C)Cl
InChI
InChI=1S/C14H18Cl2N2O2/c1-8(2)7-20-13-11(15)5-10(6-12(13)16)14(19)18-17-9(3)4/h5-6,8H,7H2,1-4H3,(H,18,19)
InChIKey
DVPVUZUETHKUBV-UHFFFAOYSA-N
Compound name
3,5-dichloro-4-(2-methylpropoxy)-N-(propan-2-ylideneamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.07452 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.08180 171.5
[M+Na]+ 339.06374 179.3
[M-H]- 315.06724 176.0
[M+NH4]+ 334.10834 188.0
[M+K]+ 355.03768 174.9
[M+H-H2O]+ 299.07178 166.5
[M+HCOO]- 361.07272 186.3
[M+CH3COO]- 375.08837 213.8
[M+Na-2H]- 337.04919 171.1
[M]+ 316.07397 177.5
[M]- 316.07507 177.5
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.