CID 544812

2-methyl-1,3-oxazolidine

Structural Information

Molecular Formula
C4H9NO
SMILES
CC1NCCO1
InChI
InChI=1S/C4H9NO/c1-4-5-2-3-6-4/h4-5H,2-3H2,1H3
InChIKey
GOPUCFKUFOFEIC-UHFFFAOYSA-N
Compound name
2-methyl-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

517
Patents

87.06841 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.075686 115.3
[M+Na]+ 110.05763 122.2
[M-H]- 86.061134 116.4
[M+NH4]+ 105.10223 137.3
[M+K]+ 126.03157 122.8
[M+H-H2O]+ 70.065670 110.0
[M+HCOO]- 132.06661 135.7
[M+CH3COO]- 146.08226 158.9
[M+Na-2H]- 108.04308 122.2
[M]+ 87.067861 111.8
[M]- 87.068959 111.8
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