CID 155858801

1311174-96-5

Structural Information

Molecular Formula
C13H26O3Si
SMILES
CC(C)(C)[Si](C)(C)OC[C@@]12[C@@H](CCC[C@@H]1O2)O
InChI
InChI=1S/C13H26O3Si/c1-12(2,3)17(4,5)15-9-13-10(14)7-6-8-11(13)16-13/h10-11,14H,6-9H2,1-5H3/t10-,11+,13-/m1/s1
InChIKey
JXADXLDFNFTSRN-NTZNESFSSA-N
Compound name
(1R,2R,6S)-1-[[tert-butyl(dimethyl)silyl]oxymethyl]-7-oxabicyclo[4.1.0]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.16513 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.17241 160.1
[M+Na]+ 281.15435 167.3
[M-H]- 257.15785 164.1
[M+NH4]+ 276.19895 174.3
[M+K]+ 297.12829 167.1
[M+H-H2O]+ 241.16239 156.0
[M+HCOO]- 303.16333 173.2
[M+CH3COO]- 317.17898 194.9
[M+Na-2H]- 279.13980 167.6
[M]+ 258.16458 164.5
[M]- 258.16568 164.5
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.