CID 13044593

(r)-2-(2,2-dimethyl-1,3-dioxolan-4-yl)propan-2-ol

Structural Information

Molecular Formula
C8H16O3
SMILES
CC1(OCC(O1)C(C)(C)O)C
InChI
InChI=1S/C8H16O3/c1-7(2,9)6-5-10-8(3,4)11-6/h6,9H,5H2,1-4H3
InChIKey
LDCYESWCZOFOEJ-UHFFFAOYSA-N
Compound name
2-(2,2-dimethyl-1,3-dioxolan-4-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

160.10994 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.11722 132.0
[M+Na]+ 183.09916 139.6
[M-H]- 159.10266 135.7
[M+NH4]+ 178.14376 153.7
[M+K]+ 199.07310 141.5
[M+H-H2O]+ 143.10720 129.4
[M+HCOO]- 205.10814 150.5
[M+CH3COO]- 219.12379 173.7
[M+Na-2H]- 181.08461 139.9
[M]+ 160.10939 133.4
[M]- 160.11049 133.4
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

patents stripe