CID 121597523

3-(trimethoxymethyl)oxolane

Structural Information

Molecular Formula
C8H16O4
SMILES
COC(C1CCOC1)(OC)OC
InChI
InChI=1S/C8H16O4/c1-9-8(10-2,11-3)7-4-5-12-6-7/h7H,4-6H2,1-3H3
InChIKey
IKGXRAAKNSYZLX-UHFFFAOYSA-N
Compound name
3-(trimethoxymethyl)oxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.10486 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.112136 136.9
[M+Na]+ 199.094078 142.8
[M-H]- 175.097584 140.6
[M+NH4]+ 194.138683 157.4
[M+K]+ 215.068018 145.2
[M+H-H2O]+ 159.102120 132.2
[M+HCOO]- 221.103061 158.0
[M+CH3COO]- 235.118711 177.5
[M+Na-2H]- 197.079526 143.5
[M]+ 176.10431142 140.2
[M]- 176.10540858 140.2
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.