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

767
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 121.1
[M+Na]+ 138.08894 129.5
[M-H]- 114.09244 124.2
[M+NH4]+ 133.13354 145.2
[M+K]+ 154.06288 130.8
[M+H-H2O]+ 98.096980 116.7
[M+HCOO]- 160.09792 142.5
[M+CH3COO]- 174.11357 168.4
[M+Na-2H]- 136.07439 128.2
[M]+ 115.09917 121.0
[M]- 115.10027 121.0
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

No patent data available for this compound.