CID 2392230

112724-92-2

Structural Information

Molecular Formula
C19H34N2O2
SMILES
CCN(C1CCCCC1)C(=O)CC(=O)N(CC)C2CCCCC2
InChI
InChI=1S/C19H34N2O2/c1-3-20(16-11-7-5-8-12-16)18(22)15-19(23)21(4-2)17-13-9-6-10-14-17/h16-17H,3-15H2,1-2H3
InChIKey
OXLFAZFQPQGKBQ-UHFFFAOYSA-N
Compound name
N,N'-dicyclohexyl-N,N'-diethylpropanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

322.26202 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.26930 183.1
[M+Na]+ 345.25124 179.9
[M-H]- 321.25474 188.9
[M+NH4]+ 340.29584 196.5
[M+K]+ 361.22518 179.8
[M+H-H2O]+ 305.25928 173.9
[M+HCOO]- 367.26022 198.8
[M+CH3COO]- 381.27587 218.8
[M+Na-2H]- 343.23669 179.3
[M]+ 322.26147 176.4
[M]- 322.26257 176.4
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