CID 119031582

1-(tert-butyldimethylsilyl)-1h-indole-4-sulfonyl chloride

Structural Information

Molecular Formula
C14H20ClNO2SSi
SMILES
CC(C)(C)[Si](C)(C)N1C=CC2=C1C=CC=C2S(=O)(=O)Cl
InChI
InChI=1S/C14H20ClNO2SSi/c1-14(2,3)20(4,5)16-10-9-11-12(16)7-6-8-13(11)19(15,17)18/h6-10H,1-5H3
InChIKey
VEQXIFOMHICKOD-UHFFFAOYSA-N
Compound name
1-[tert-butyl(dimethyl)silyl]indole-4-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.06726 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.07454 176.1
[M+Na]+ 352.05648 187.4
[M-H]- 328.05998 180.5
[M+NH4]+ 347.10108 194.5
[M+K]+ 368.03042 182.3
[M+H-H2O]+ 312.06452 171.5
[M+HCOO]- 374.06546 185.6
[M+CH3COO]- 388.08111 202.1
[M+Na-2H]- 350.04193 180.5
[M]+ 329.06671 184.4
[M]- 329.06781 184.4
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

No patent data available for this compound.