CID 3020137

2-(ethylamino)-n,n-dimethylbutyramide

Structural Information

Molecular Formula
C8H18N2O
SMILES
CCC(C(=O)N(C)C)NCC
InChI
InChI=1S/C8H18N2O/c1-5-7(9-6-2)8(11)10(3)4/h7,9H,5-6H2,1-4H3
InChIKey
WDMZZHGFIDHAFR-UHFFFAOYSA-N
Compound name
2-(ethylamino)-N,N-dimethylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.1419 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.149176 139.3
[M+Na]+ 181.131118 144.0
[M-H]- 157.134624 140.8
[M+NH4]+ 176.175723 160.3
[M+K]+ 197.105058 145.4
[M+H-H2O]+ 141.139160 133.5
[M+HCOO]- 203.140101 163.4
[M+CH3COO]- 217.155751 188.6
[M+Na-2H]- 179.116566 142.3
[M]+ 158.14135142 140.3
[M]- 158.14244858 140.3
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

No patent data available for this compound.