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]+ 145.122316 129.8
[M+Na]+ 167.104258 137.7
[M-H]- 143.107764 133.3
[M+NH4]+ 162.148863 148.8
[M+K]+ 183.078198 140.0
[M+H-H2O]+ 127.112300 123.5
[M+HCOO]- 189.113241 150.3
[M+CH3COO]- 203.128891 177.7
[M+Na-2H]- 165.089706 136.2
[M]+ 144.11449142 140.1
[M]- 144.11558858 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.