CID 19790878

852324-38-0

Structural Information

Molecular Formula
C9H15NO3
SMILES
CC(C)(C)OC(=O)N1CCC1C=O
InChI
InChI=1S/C9H15NO3/c1-9(2,3)13-8(12)10-5-4-7(10)6-11/h6-7H,4-5H2,1-3H3
InChIKey
UEGGEIJWHPDPLL-UHFFFAOYSA-N
Compound name
tert-butyl 2-formylazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

75
Patents

185.1052 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 140.2
[M+Na]+ 208.09442 146.1
[M-H]- 184.09792 142.5
[M+NH4]+ 203.13902 152.6
[M+K]+ 224.06836 149.2
[M+H-H2O]+ 168.10246 129.8
[M+HCOO]- 230.10340 158.6
[M+CH3COO]- 244.11905 184.6
[M+Na-2H]- 206.07987 144.3
[M]+ 185.10465 150.7
[M]- 185.10575 150.7
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

patents stripe