CID 24844132

Brn 1634642

Structural Information

Molecular Formula
C10H20O3
SMILES
CC1(C(CCC(O1)(C)CO)CO)C
InChI
InChI=1S/C10H20O3/c1-9(2)8(6-11)4-5-10(3,7-12)13-9/h8,11-12H,4-7H2,1-3H3
InChIKey
BBTHHMYINDYBIF-UHFFFAOYSA-N
Compound name
[6-(hydroxymethyl)-2,2,6-trimethyloxan-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.14125 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.14853 141.3
[M+Na]+ 211.13047 151.2
[M+NH4]+ 206.17507 151.6
[M+K]+ 227.10441 143.2
[M-H]- 187.13397 143.0
[M+Na-2H]- 209.11592 147.1
[M]+ 188.14070 143.4
[M]- 188.14180 143.4
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.