CID 6434925

Butyramide, 2-(2-butenylthio)-2-ethyl-n-methyl-

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]+ 216.141656 153.1
[M+Na]+ 238.123598 158.1
[M-H]- 214.127104 152.9
[M+NH4]+ 233.168203 172.1
[M+K]+ 254.097538 155.4
[M+H-H2O]+ 198.131640 147.6
[M+HCOO]- 260.132581 168.8
[M+CH3COO]- 274.148231 190.8
[M+Na-2H]- 236.109046 153.9
[M]+ 215.13383142 156.1
[M]- 215.13492858 156.1
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.