CID 23384747

1-methoxy-2,3-dimethylbutan-2-ol

Structural Information

Molecular Formula
C7H16O2
SMILES
CC(C)C(C)(COC)O
InChI
InChI=1S/C7H16O2/c1-6(2)7(3,8)5-9-4/h6,8H,5H2,1-4H3
InChIKey
NVTWSAVVAUNPKP-UHFFFAOYSA-N
Compound name
1-methoxy-2,3-dimethylbutan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

132.11504 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.12232 130.0
[M+Na]+ 155.10426 136.7
[M-H]- 131.10776 129.1
[M+NH4]+ 150.14886 151.7
[M+K]+ 171.07820 137.1
[M+H-H2O]+ 115.11230 126.3
[M+HCOO]- 177.11324 150.0
[M+CH3COO]- 191.12889 172.6
[M+Na-2H]- 153.08971 135.5
[M]+ 132.11449 131.6
[M]- 132.11559 131.6
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

patents stripe