CID 3032548

Phenyl dimethicone

Structural Information

Molecular Formula
C7H8OSi
SMILES
C[Si](=O)C1=CC=CC=C1
InChI
InChI=1S/C7H8OSi/c1-9(8)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey
IXKNJYSAWNJQQY-UHFFFAOYSA-N
Compound name
methyl-oxo-phenylsilane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

314
Patents

136.03444 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.04172 123.0
[M+Na]+ 159.02366 130.8
[M-H]- 135.02716 126.8
[M+NH4]+ 154.06826 145.3
[M+K]+ 174.99760 129.7
[M+H-H2O]+ 119.03170 117.7
[M+HCOO]- 181.03264 147.3
[M+CH3COO]- 195.04829 170.5
[M+Na-2H]- 157.00911 130.5
[M]+ 136.03389 122.6
[M]- 136.03499 122.6
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