CID 458829

N,n'-bis(4-methoxyphenyl)butanediamide

Structural Information

Molecular Formula
C18H20N2O4
SMILES
COC1=CC=C(C=C1)NC(=O)CCC(=O)NC2=CC=C(C=C2)OC
InChI
InChI=1S/C18H20N2O4/c1-23-15-7-3-13(4-8-15)19-17(21)11-12-18(22)20-14-5-9-16(24-2)10-6-14/h3-10H,11-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKey
UPPWPFCEOQWHMO-UHFFFAOYSA-N
Compound name
N,N'-bis(4-methoxyphenyl)butanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

328.1423 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.149576 176.8
[M+Na]+ 351.131518 181.4
[M-H]- 327.135024 183.2
[M+NH4]+ 346.176123 189.7
[M+K]+ 367.105458 178.9
[M+H-H2O]+ 311.139560 167.7
[M+HCOO]- 373.140501 201.0
[M+CH3COO]- 387.156151 213.5
[M+Na-2H]- 349.116966 179.7
[M]+ 328.14175142 179.4
[M]- 328.14284858 179.4
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

patents stripe