CID 123206707

2-(oxiran-2-yl)oxane

Structural Information

Molecular Formula
C7H12O2
SMILES
C1CCOC(C1)C2CO2
InChI
InChI=1S/C7H12O2/c1-2-4-8-6(3-1)7-5-9-7/h6-7H,1-5H2
InChIKey
AOBPJRUSKYFWDU-UHFFFAOYSA-N
Compound name
2-(oxiran-2-yl)oxane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

128.08372 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.090996 125.3
[M+Na]+ 151.072938 132.7
[M-H]- 127.076444 133.7
[M+NH4]+ 146.117543 139.7
[M+K]+ 167.046878 134.6
[M+H-H2O]+ 111.080980 118.7
[M+HCOO]- 173.081921 145.0
[M+CH3COO]- 187.097571 172.9
[M+Na-2H]- 149.058386 134.0
[M]+ 128.08317142 125.6
[M]- 128.08426858 125.6
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