CID 3040955

Acetamide, n-ethyl-n-(2-propylpentyl)-

Structural Information

Molecular Formula
C12H25NO
SMILES
CCCC(CCC)CN(CC)C(=O)C
InChI
InChI=1S/C12H25NO/c1-5-8-12(9-6-2)10-13(7-3)11(4)14/h12H,5-10H2,1-4H3
InChIKey
LYUWNWKLTCEFLV-UHFFFAOYSA-N
Compound name
N-ethyl-N-(2-propylpentyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.19362 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.20090 153.3
[M+Na]+ 222.18284 157.3
[M-H]- 198.18634 154.2
[M+NH4]+ 217.22744 173.1
[M+K]+ 238.15678 157.7
[M+H-H2O]+ 182.19088 147.4
[M+HCOO]- 244.19182 175.1
[M+CH3COO]- 258.20747 195.8
[M+Na-2H]- 220.16829 154.1
[M]+ 199.19307 156.7
[M]- 199.19417 156.7
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

No patent data available for this compound.