CID 9881821

Silthiofam

Structural Information

Molecular Formula
C13H21NOSSi
SMILES
CC1=C(SC(=C1C(=O)NCC=C)[Si](C)(C)C)C
InChI
InChI=1S/C13H21NOSSi/c1-7-8-14-12(15)11-9(2)10(3)16-13(11)17(4,5)6/h7H,1,8H2,2-6H3,(H,14,15)
InChIKey
MXMXHPPIGKYTAR-UHFFFAOYSA-N
Compound name
4,5-dimethyl-N-prop-2-enyl-2-trimethylsilylthiophene-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

1
References

23384
Patents

267.1113 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.11858 162.2
[M+Na]+ 290.10052 170.1
[M-H]- 266.10402 166.3
[M+NH4]+ 285.14512 182.2
[M+K]+ 306.07446 166.3
[M+H-H2O]+ 250.10856 156.9
[M+HCOO]- 312.10950 179.3
[M+CH3COO]- 326.12515 199.4
[M+Na-2H]- 288.08597 160.3
[M]+ 267.11075 166.1
[M]- 267.11185 166.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe