CID 12454215

2-(trimethylsilyl)cyclopent-2-en-1-one

Structural Information

Molecular Formula
C8H14OSi
SMILES
C[Si](C)(C)C1=CCCC1=O
InChI
InChI=1S/C8H14OSi/c1-10(2,3)8-6-4-5-7(8)9/h6H,4-5H2,1-3H3
InChIKey
JREFDYKOYRJDQC-UHFFFAOYSA-N
Compound name
2-trimethylsilylcyclopent-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

154.08139 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.08867 131.2
[M+Na]+ 177.07061 139.1
[M-H]- 153.07411 134.9
[M+NH4]+ 172.11521 155.0
[M+K]+ 193.04455 138.0
[M+H-H2O]+ 137.07865 126.9
[M+HCOO]- 199.07959 153.8
[M+CH3COO]- 213.09524 174.6
[M+Na-2H]- 175.05606 136.1
[M]+ 154.08084 131.0
[M]- 154.08194 131.0
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