CID 6434925

2-(2-butenylthio)-2-ethyl-n-methylbutyramide

Structural Information

Molecular Formula
C11H21NOS
SMILES
CCC(CC)(C(=O)NC)SC/C=C/C
InChI
InChI=1S/C11H21NOS/c1-5-8-9-14-11(6-2,7-3)10(13)12-4/h5,8H,6-7,9H2,1-4H3,(H,12,13)/b8-5+
InChIKey
SFUKIIFEMBLSQA-VMPITWQZSA-N
Compound name
2-[(E)-but-2-enyl]sulfanyl-2-ethyl-N-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.13438 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.14166 155.0
[M+Na]+ 238.12360 162.6
[M+NH4]+ 233.16820 161.9
[M+K]+ 254.09754 155.2
[M-H]- 214.12710 154.0
[M+Na-2H]- 236.10905 156.4
[M]+ 215.13383 156.0
[M]- 215.13493 156.0
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.