CID 62271

3,4,4-trimethyloxazolidine

Structural Information

Molecular Formula
C6H13NO
SMILES
CC1(COCN1C)C
InChI
InChI=1S/C6H13NO/c1-6(2)4-8-5-7(6)3/h4-5H2,1-3H3
InChIKey
VJMGCRKBPXGKAH-UHFFFAOYSA-N
Compound name
3,4,4-trimethyl-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

658
Patents

115.09972 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 122.9
[M+Na]+ 138.08894 133.8
[M+NH4]+ 133.13354 133.1
[M+K]+ 154.06288 128.7
[M-H]- 114.09244 125.1
[M+Na-2H]- 136.07439 128.7
[M]+ 115.09917 125.1
[M]- 115.10027 125.1
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