CID 70649

1078-96-2

Structural Information

Molecular Formula
C10H11Cl2NSi
SMILES
C1=CC=C(C=C1)[Si](CCCC#N)(Cl)Cl
InChI
InChI=1S/C10H11Cl2NSi/c11-14(12,9-5-4-8-13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,9H2
InChIKey
NNDVJVQRHQFKNA-UHFFFAOYSA-N
Compound name
4-[dichloro(phenyl)silyl]butanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

103
Patents

243.00378 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.01106 153.3
[M+Na]+ 265.99300 164.0
[M-H]- 241.99650 155.6
[M+NH4]+ 261.03760 170.8
[M+K]+ 281.96694 157.0
[M+H-H2O]+ 226.00104 142.6
[M+HCOO]- 288.00198 163.4
[M+CH3COO]- 302.01763 199.2
[M+Na-2H]- 263.97845 158.8
[M]+ 243.00323 151.1
[M]- 243.00433 151.1
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

patents stripe