CID 162497793

2230030-49-4

Structural Information

Molecular Formula
C13H10IO4Si
SMILES
C1=CC=C2C(=C1)O[Si-]3(O2)(OC4=CC=CC=C4O3)CI
InChI
InChI=1S/C13H10IO4Si/c14-9-19(15-10-5-1-2-6-11(10)16-19)17-12-7-3-4-8-13(12)18-19/h1-8H,9H2/q-1
InChIKey
DZNRKEIFGZLCNB-UHFFFAOYSA-N
Compound name
8-(iodomethyl)-8,8'-spirobi[7,9-dioxa-8-silanuidabicyclo[4.3.0]nona-1,3,5-triene]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

384.9393 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.94658 159.6
[M+Na]+ 407.92852 164.9
[M+NH4]+ 402.97312 164.0
[M+K]+ 423.90246 167.1
[M-H]- 383.93202 161.1
[M+Na-2H]- 405.91397 150.2
[M]+ 384.93875 159.5
[M]- 384.93985 159.5
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

No patent data available for this compound.