CID 20434

2-methyl-2-isopropyl-1,3-dioxolane

Structural Information

Molecular Formula
C7H14O2
SMILES
CC(C)C1(OCCO1)C
InChI
InChI=1S/C7H14O2/c1-6(2)7(3)8-4-5-9-7/h6H,4-5H2,1-3H3
InChIKey
IGZQZZODNMBJLU-UHFFFAOYSA-N
Compound name
2-methyl-2-propan-2-yl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

130.09938 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.106656 126.3
[M+Na]+ 153.088598 133.1
[M-H]- 129.092104 131.0
[M+NH4]+ 148.133203 149.4
[M+K]+ 169.062538 135.8
[M+H-H2O]+ 113.096640 122.7
[M+HCOO]- 175.097581 146.8
[M+CH3COO]- 189.113231 170.7
[M+Na-2H]- 151.074046 133.3
[M]+ 130.09883142 127.0
[M]- 130.09992858 127.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe