CID 122240137

2-methyl-2-(oxolan-3-yl)propan-1-ol

Structural Information

Molecular Formula
C8H16O2
SMILES
CC(C)(CO)C1CCOC1
InChI
InChI=1S/C8H16O2/c1-8(2,6-9)7-3-4-10-5-7/h7,9H,3-6H2,1-2H3
InChIKey
MIJFZNUNQMPJGG-UHFFFAOYSA-N
Compound name
2-methyl-2-(oxolan-3-yl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.11504 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.122316 132.1
[M+Na]+ 167.104258 137.8
[M-H]- 143.107764 134.5
[M+NH4]+ 162.148863 153.4
[M+K]+ 183.078198 138.2
[M+H-H2O]+ 127.112300 128.0
[M+HCOO]- 189.113241 151.2
[M+CH3COO]- 203.128891 170.8
[M+Na-2H]- 165.089706 137.9
[M]+ 144.11449142 130.6
[M]- 144.11558858 130.6
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.