CID 113553

((isopropoxymethoxy)methoxy)methanol

Structural Information

Molecular Formula
C6H14O4
SMILES
CC(C)OCOCOCO
InChI
InChI=1S/C6H14O4/c1-6(2)10-5-9-4-8-3-7/h6-7H,3-5H2,1-2H3
InChIKey
CKTKXGAZWKOZAP-UHFFFAOYSA-N
Compound name
propan-2-yloxymethoxymethoxymethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.0892 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.096476 131.4
[M+Na]+ 173.078418 137.9
[M-H]- 149.081924 130.2
[M+NH4]+ 168.123023 152.0
[M+K]+ 189.052358 139.1
[M+H-H2O]+ 133.086460 126.6
[M+HCOO]- 195.087401 153.7
[M+CH3COO]- 209.103051 173.3
[M+Na-2H]- 171.063866 136.8
[M]+ 150.08865142 136.0
[M]- 150.08974858 136.0
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.