CID 61287780

4-(oxiran-2-ylmethoxy)oxane

Structural Information

Molecular Formula
C8H14O3
SMILES
C1COCCC1OCC2CO2
InChI
InChI=1S/C8H14O3/c1-3-9-4-2-7(1)10-5-8-6-11-8/h7-8H,1-6H2
InChIKey
QXKMLCCQTVGXQI-UHFFFAOYSA-N
Compound name
4-(oxiran-2-ylmethoxy)oxane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

158.0943 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.101576 133.1
[M+Na]+ 181.083518 140.1
[M-H]- 157.087024 141.4
[M+NH4]+ 176.128123 146.4
[M+K]+ 197.057458 142.0
[M+H-H2O]+ 141.091560 126.3
[M+HCOO]- 203.092501 152.7
[M+CH3COO]- 217.108151 177.8
[M+Na-2H]- 179.068966 141.3
[M]+ 158.09375142 135.3
[M]- 158.09484858 135.3
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