CID 145867325

N-(but-3-yn-1-yl)-n-tert-butylacetamide

Structural Information

Molecular Formula
C10H17NO
SMILES
CC(=O)N(CCC#C)C(C)(C)C
InChI
InChI=1S/C10H17NO/c1-6-7-8-11(9(2)12)10(3,4)5/h1H,7-8H2,2-5H3
InChIKey
LFGLAQLNRFYFJW-UHFFFAOYSA-N
Compound name
N-tert-butyl-N-but-3-ynylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 139.2
[M+Na]+ 190.12023 148.1
[M+NH4]+ 185.16483 143.0
[M+K]+ 206.09417 140.8
[M-H]- 166.12373 130.9
[M+Na-2H]- 188.10568 139.8
[M]+ 167.13046 137.2
[M]- 167.13156 137.2
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.