CID 123335

N,n'-dipropyloxamide

Structural Information

Molecular Formula
C8H16N2O2
SMILES
CCCNC(=O)C(=O)NCCC
InChI
InChI=1S/C8H16N2O2/c1-3-5-9-7(11)8(12)10-6-4-2/h3-6H2,1-2H3,(H,9,11)(H,10,12)
InChIKey
FRZWXXLIRIYHFT-UHFFFAOYSA-N
Compound name
N,N'-dipropyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

172.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 141.0
[M+Na]+ 195.11041 145.9
[M-H]- 171.11391 141.0
[M+NH4]+ 190.15501 160.8
[M+K]+ 211.08435 145.8
[M+H-H2O]+ 155.11845 135.2
[M+HCOO]- 217.11939 165.0
[M+CH3COO]- 231.13504 184.8
[M+Na-2H]- 193.09586 144.8
[M]+ 172.12064 141.3
[M]- 172.12174 141.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe