CID 57470141

1-(oxolan-2-yl)propan-2-ol

Structural Information

Molecular Formula
C7H14O2
SMILES
CC(CC1CCCO1)O
InChI
InChI=1S/C7H14O2/c1-6(8)5-7-3-2-4-9-7/h6-8H,2-5H2,1H3
InChIKey
CAHGFMDHALWJAS-UHFFFAOYSA-N
Compound name
1-(oxolan-2-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

130.09938 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.106656 128.8
[M+Na]+ 153.088598 134.2
[M-H]- 129.092104 131.1
[M+NH4]+ 148.133203 150.4
[M+K]+ 169.062538 134.8
[M+H-H2O]+ 113.096640 124.1
[M+HCOO]- 175.097581 148.7
[M+CH3COO]- 189.113231 168.3
[M+Na-2H]- 151.074046 133.0
[M]+ 130.09883142 126.7
[M]- 130.09992858 126.7
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