CID 42625062

1130490-92-4

Structural Information

Molecular Formula
C16H23BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CCC3=CC=CC=C3C2
InChI
InChI=1S/C16H23BO2/c1-15(2)16(3,4)19-17(18-15)14-10-9-12-7-5-6-8-13(12)11-14/h5-8,14H,9-11H2,1-4H3
InChIKey
OMHXKOBTZOWRPG-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.1791 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.18638 157.9
[M+Na]+ 281.16832 165.8
[M-H]- 257.17182 166.7
[M+NH4]+ 276.21292 179.4
[M+K]+ 297.14226 164.8
[M+H-H2O]+ 241.17636 152.5
[M+HCOO]- 303.17730 174.8
[M+CH3COO]- 317.19295 170.8
[M+Na-2H]- 279.15377 162.8
[M]+ 258.17855 157.8
[M]- 258.17965 157.8
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.