CID 154577423

2418724-04-4

Structural Information

Molecular Formula
C12H19NO4
SMILES
CC(C)(C)OC(=O)N1CCOCC1(C=C)C=O
InChI
InChI=1S/C12H19NO4/c1-5-12(8-14)9-16-7-6-13(12)10(15)17-11(2,3)4/h5,8H,1,6-7,9H2,2-4H3
InChIKey
XCDSCCUFSRAPRY-UHFFFAOYSA-N
Compound name
tert-butyl 3-ethenyl-3-formylmorpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.13141 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.13869 153.3
[M+Na]+ 264.12063 159.4
[M-H]- 240.12413 155.6
[M+NH4]+ 259.16523 170.3
[M+K]+ 280.09457 159.9
[M+H-H2O]+ 224.12867 148.0
[M+HCOO]- 286.12961 169.3
[M+CH3COO]- 300.14526 189.6
[M+Na-2H]- 262.10608 158.6
[M]+ 241.13086 154.4
[M]- 241.13196 154.4
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.