CID 46739735

862129-81-5

Structural Information

Molecular Formula
C11H19BO2S
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CCSCC2
InChI
InChI=1S/C11H19BO2S/c1-10(2)11(3,4)14-12(13-10)9-5-7-15-8-6-9/h5H,6-8H2,1-4H3
InChIKey
QZVRTORVCKGPPY-UHFFFAOYSA-N
Compound name
2-(3,6-dihydro-2H-thiopyran-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

284
Patents

226.11989 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.12717 148.1
[M+Na]+ 249.10911 158.9
[M+NH4]+ 244.15371 160.4
[M+K]+ 265.08305 149.7
[M-H]- 225.11261 154.3
[M+Na-2H]- 247.09456 155.3
[M]+ 226.11934 152.3
[M]- 226.12044 152.3
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

patents stripe