CID 154814450

Tert-butyl 3-ethenyl-3-ethynylmorpholine-4-carboxylate

Structural Information

Molecular Formula
C13H19NO3
SMILES
CC(C)(C)OC(=O)N1CCOCC1(C=C)C#C
InChI
InChI=1S/C13H19NO3/c1-6-13(7-2)10-16-9-8-14(13)11(15)17-12(3,4)5/h1,7H,2,8-10H2,3-5H3
InChIKey
UZPAXXQVACHSPW-UHFFFAOYSA-N
Compound name
tert-butyl 3-ethenyl-3-ethynylmorpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.13649 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.14377 152.1
[M+Na]+ 260.12571 160.4
[M-H]- 236.12921 153.1
[M+NH4]+ 255.17031 167.4
[M+K]+ 276.09965 158.4
[M+H-H2O]+ 220.13375 140.7
[M+HCOO]- 282.13469 162.6
[M+CH3COO]- 296.15034 197.0
[M+Na-2H]- 258.11116 156.0
[M]+ 237.13594 146.7
[M]- 237.13704 146.7
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

No patent data available for this compound.