CID 121763

2-ethyl-2-methyloxirane

Structural Information

Molecular Formula
C5H10O
SMILES
CCC1(CO1)C
InChI
InChI=1S/C5H10O/c1-3-5(2)4-6-5/h3-4H2,1-2H3
InChIKey
QZXUQPKFNQQQAJ-UHFFFAOYSA-N
Compound name
2-ethyl-2-methyloxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1203
Patents

86.073166 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 87.080442 115.9
[M+Na]+ 109.06238 126.2
[M-H]- 85.065890 122.0
[M+NH4]+ 104.10699 135.7
[M+K]+ 125.03632 127.8
[M+H-H2O]+ 69.070426 111.6
[M+HCOO]- 131.07137 139.2
[M+CH3COO]- 145.08702 168.1
[M+Na-2H]- 107.04783 126.3
[M]+ 86.072617 120.4
[M]- 86.073715 120.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe