CID 123627900

3-chloro-5,5-dimethyl-5h-dibenzo[b,d]silole

Structural Information

Molecular Formula
C14H13ClSi
SMILES
C[Si]1(C2=CC=CC=C2C3=C1C=C(C=C3)Cl)C
InChI
InChI=1S/C14H13ClSi/c1-16(2)13-6-4-3-5-11(13)12-8-7-10(15)9-14(12)16/h3-9H,1-2H3
InChIKey
BQFCXBHLCVANDD-UHFFFAOYSA-N
Compound name
3-chloro-5,5-dimethylbenzo[b][1]benzosilole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

244.0475 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.05478 151.6
[M+Na]+ 267.03672 164.0
[M-H]- 243.04022 157.8
[M+NH4]+ 262.08132 177.2
[M+K]+ 283.01066 157.2
[M+H-H2O]+ 227.04476 146.7
[M+HCOO]- 289.04570 170.0
[M+CH3COO]- 303.06135 166.0
[M+Na-2H]- 265.02217 158.1
[M]+ 244.04695 155.3
[M]- 244.04805 155.3
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