CID 542357

3-methoxy-2-(methoxymethyl)-2-methylpropan-1-ol

Structural Information

Molecular Formula
C7H16O3
SMILES
CC(CO)(COC)COC
InChI
InChI=1S/C7H16O3/c1-7(4-8,5-9-2)6-10-3/h8H,4-6H2,1-3H3
InChIKey
GJDPWHURBFNYAV-UHFFFAOYSA-N
Compound name
3-methoxy-2-(methoxymethyl)-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

148.10994 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.117216 133.1
[M+Na]+ 171.099158 139.9
[M-H]- 147.102664 132.1
[M+NH4]+ 166.143763 154.1
[M+K]+ 187.073098 140.3
[M+H-H2O]+ 131.107200 129.0
[M+HCOO]- 193.108141 154.3
[M+CH3COO]- 207.123791 173.8
[M+Na-2H]- 169.084606 139.9
[M]+ 148.10939142 136.8
[M]- 148.11048858 136.8
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