CID 580979

Ethyl 3-(morpholin-4-yl)but-2-enoate

Structural Information

Molecular Formula
C10H17NO3
SMILES
CCOC(=O)C=C(C)N1CCOCC1
InChI
InChI=1S/C10H17NO3/c1-3-14-10(12)8-9(2)11-4-6-13-7-5-11/h8H,3-7H2,1-2H3
InChIKey
CENCNIGVANECFS-UHFFFAOYSA-N
Compound name
ethyl 3-morpholin-4-ylbut-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

2
Patents

199.12085 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.12813 146.1
[M+Na]+ 222.11007 150.2
[M-H]- 198.11357 147.8
[M+NH4]+ 217.15467 162.3
[M+K]+ 238.08401 150.9
[M+H-H2O]+ 182.11811 139.2
[M+HCOO]- 244.11905 162.9
[M+CH3COO]- 258.13470 182.8
[M+Na-2H]- 220.09552 149.3
[M]+ 199.12030 144.8
[M]- 199.12140 144.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.