CID 211203

22635-25-2

Structural Information

Molecular Formula
C11H21NO
SMILES
CCCC(CCC)C(=O)NCC=C
InChI
InChI=1S/C11H21NO/c1-4-7-10(8-5-2)11(13)12-9-6-3/h6,10H,3-5,7-9H2,1-2H3,(H,12,13)
InChIKey
RRSWPFXXIOCGSK-UHFFFAOYSA-N
Compound name
N-prop-2-enyl-2-propylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.16231 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.16959 147.4
[M+Na]+ 206.15153 151.9
[M-H]- 182.15503 146.9
[M+NH4]+ 201.19613 167.0
[M+K]+ 222.12547 150.5
[M+H-H2O]+ 166.15957 141.8
[M+HCOO]- 228.16051 169.2
[M+CH3COO]- 242.17616 188.3
[M+Na-2H]- 204.13698 149.4
[M]+ 183.16176 148.4
[M]- 183.16286 148.4
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

No patent data available for this compound.