CID 70687

N,n-dipropylpropanamide

Structural Information

Molecular Formula
C9H19NO
SMILES
CCCN(CCC)C(=O)CC
InChI
InChI=1S/C9H19NO/c1-4-7-10(8-5-2)9(11)6-3/h4-8H2,1-3H3
InChIKey
ARCMPHHHUFVAOI-UHFFFAOYSA-N
Compound name
N,N-dipropylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

469
Patents

157.14667 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.153946 139.0
[M+Na]+ 180.135888 144.4
[M-H]- 156.139394 140.3
[M+NH4]+ 175.180493 160.5
[M+K]+ 196.109828 145.1
[M+H-H2O]+ 140.143930 133.5
[M+HCOO]- 202.144871 162.8
[M+CH3COO]- 216.160521 185.9
[M+Na-2H]- 178.121336 142.6
[M]+ 157.14612142 141.9
[M]- 157.14721858 141.9
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