CID 53413549

4-phenylbutylmethyldichlorosilane

Structural Information

Molecular Formula
C11H16Cl2Si
SMILES
C[Si](CCCCC1=CC=CC=C1)(Cl)Cl
InChI
InChI=1S/C11H16Cl2Si/c1-14(12,13)10-6-5-9-11-7-3-2-4-8-11/h2-4,7-8H,5-6,9-10H2,1H3
InChIKey
MEBCFWIOGCOGTB-UHFFFAOYSA-N
Compound name
dichloro-methyl-(4-phenylbutyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

98
Patents

246.03983 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.04711 152.4
[M+Na]+ 269.02905 160.2
[M-H]- 245.03255 154.7
[M+NH4]+ 264.07365 171.8
[M+K]+ 285.00299 154.3
[M+H-H2O]+ 229.03709 148.0
[M+HCOO]- 291.03803 164.6
[M+CH3COO]- 305.05368 189.6
[M+Na-2H]- 267.01450 158.1
[M]+ 246.03928 155.9
[M]- 246.04038 155.9
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

patents stripe