CID 165943548

Tert-butyl 2-ethenyl-2-methylazetidine-1-carboxylate

Structural Information

Molecular Formula
C11H19NO2
SMILES
CC1(CCN1C(=O)OC(C)(C)C)C=C
InChI
InChI=1S/C11H19NO2/c1-6-11(5)7-8-12(11)9(13)14-10(2,3)4/h6H,1,7-8H2,2-5H3
InChIKey
MLFMANDNSASEGG-UHFFFAOYSA-N
Compound name
tert-butyl 2-ethenyl-2-methylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 147.4
[M+Na]+ 220.13081 153.5
[M-H]- 196.13431 149.8
[M+NH4]+ 215.17541 161.5
[M+K]+ 236.10475 155.7
[M+H-H2O]+ 180.13885 138.3
[M+HCOO]- 242.13979 165.0
[M+CH3COO]- 256.15544 188.1
[M+Na-2H]- 218.11626 151.5
[M]+ 197.14104 157.6
[M]- 197.14214 157.6
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

No patent data available for this compound.