CID 3485713

1-(2-methoxyethoxy)-2-methylpropan-2-ol

Structural Information

Molecular Formula
C7H16O3
SMILES
CC(C)(COCCOC)O
InChI
InChI=1S/C7H16O3/c1-7(2,8)6-10-5-4-9-3/h8H,4-6H2,1-3H3
InChIKey
SIUWDFVMEASCRP-UHFFFAOYSA-N
Compound name
1-(2-methoxyethoxy)-2-methylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

395
Patents

148.10994 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.11722 133.1
[M+Na]+ 171.09916 139.9
[M-H]- 147.10266 132.1
[M+NH4]+ 166.14376 154.1
[M+K]+ 187.07310 140.3
[M+H-H2O]+ 131.10720 129.0
[M+HCOO]- 193.10814 154.3
[M+CH3COO]- 207.12379 173.8
[M+Na-2H]- 169.08461 139.9
[M]+ 148.10939 136.8
[M]- 148.11049 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

literature stripe

Patent stripe

patents stripe