CID 130755090

Rac-(3r,4r)-4-(methylsulfanyl)oxolan-3-ol

Structural Information

Molecular Formula
C5H10O2S
SMILES
CS[C@@H]1COC[C@H]1O
InChI
InChI=1S/C5H10O2S/c1-8-5-3-7-2-4(5)6/h4-6H,2-3H2,1H3/t4-,5-/m1/s1
InChIKey
ATVYTDNUOBDOAH-RFZPGFLSSA-N
Compound name
(3R,4R)-4-methylsulfanyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

134.04015 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.047426 125.2
[M+Na]+ 157.029368 133.0
[M-H]- 133.032874 128.4
[M+NH4]+ 152.073973 147.7
[M+K]+ 173.003308 132.9
[M+H-H2O]+ 117.037410 121.1
[M+HCOO]- 179.038351 141.7
[M+CH3COO]- 193.054001 166.4
[M+Na-2H]- 155.014816 127.7
[M]+ 134.03960142 125.7
[M]- 134.04069858 125.7
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.