CID 71756846

3-methoxy-2,2,3-trimethylcyclobutan-1-ol

Structural Information

Molecular Formula
C8H16O2
SMILES
CC1(C(CC1(C)OC)O)C
InChI
InChI=1S/C8H16O2/c1-7(2)6(9)5-8(7,3)10-4/h6,9H,5H2,1-4H3
InChIKey
WXFNPCZRWOCQBQ-UHFFFAOYSA-N
Compound name
3-methoxy-2,2,3-trimethylcyclobutan-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]+ 145.12232 129.8
[M+Na]+ 167.10426 137.7
[M-H]- 143.10776 133.3
[M+NH4]+ 162.14886 148.8
[M+K]+ 183.07820 140.0
[M+H-H2O]+ 127.11230 123.5
[M+HCOO]- 189.11324 150.3
[M+CH3COO]- 203.12889 177.7
[M+Na-2H]- 165.08971 136.2
[M]+ 144.11449 140.1
[M]- 144.11559 140.1
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.