CID 10137871

(1r,3r)-5-(bromomethylene)-1,3-bis(tert-butyldimethylsilyloxy)cyclohexane

Structural Information

Molecular Formula
C19H39BrO2Si2
SMILES
CC(C)(C)[Si](C)(C)O[C@H]1C[C@@H](CC(=CBr)C1)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C19H39BrO2Si2/c1-18(2,3)23(7,8)21-16-11-15(14-20)12-17(13-16)22-24(9,10)19(4,5)6/h14,16-17H,11-13H2,1-10H3/t16-,17-/m1/s1
InChIKey
GCYQQWTZQGQJBW-IAGOWNOFSA-N
Compound name
[(1R,5R)-3-(bromomethylidene)-5-[tert-butyl(dimethyl)silyl]oxycyclohexyl]oxy-tert-butyl-dimethylsilane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

434.1672 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.17448 200.2
[M+Na]+ 457.15642 206.7
[M-H]- 433.15992 204.7
[M+NH4]+ 452.20102 215.8
[M+K]+ 473.13036 195.9
[M+H-H2O]+ 417.16446 200.6
[M+HCOO]- 479.16540 208.7
[M+CH3COO]- 493.18105 222.0
[M+Na-2H]- 455.14187 202.6
[M]+ 434.16665 219.1
[M]- 434.16775 219.1
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

No patent data available for this compound.