CID 167732021

129813-24-7

Structural Information

Molecular Formula
C10H19BO2S
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C/CSC
InChI
InChI=1S/C10H19BO2S/c1-9(2)10(3,4)13-11(12-9)7-6-8-14-5/h6-7H,8H2,1-5H3/b7-6+
InChIKey
ZHLSTCLOJCDARP-VOTSOKGWSA-N
Compound name
4,4,5,5-tetramethyl-2-[(E)-3-methylsulfanylprop-1-enyl]-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.11989 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.12717 141.5
[M+Na]+ 237.10911 150.1
[M-H]- 213.11261 146.7
[M+NH4]+ 232.15371 164.6
[M+K]+ 253.08305 150.6
[M+H-H2O]+ 197.11715 139.0
[M+HCOO]- 259.11809 157.1
[M+CH3COO]- 273.13374 185.6
[M+Na-2H]- 235.09456 145.5
[M]+ 214.11934 147.0
[M]- 214.12044 147.0
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.