CID 25405

Bis(3,4-epoxybutyl) ether

Structural Information

Molecular Formula
C8H14O3
SMILES
C1C(O1)CCOCCC2CO2
InChI
InChI=1S/C8H14O3/c1(7-5-10-7)3-9-4-2-8-6-11-8/h7-8H,1-6H2
InChIKey
CMZHETMDWDVBCX-UHFFFAOYSA-N
Compound name
2-[2-[2-(oxiran-2-yl)ethoxy]ethyl]oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

173
Patents

158.0943 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.10158 144.9
[M+Na]+ 181.08352 152.4
[M-H]- 157.08702 153.4
[M+NH4]+ 176.12812 152.3
[M+K]+ 197.05746 154.3
[M+H-H2O]+ 141.09156 138.0
[M+HCOO]- 203.09250 164.0
[M+CH3COO]- 217.10815 189.7
[M+Na-2H]- 179.06897 151.2
[M]+ 158.09375 152.9
[M]- 158.09485 152.9
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