CID 171021

2-[[(butylamino)carbonyl]oxy]ethyl methacrylate

Structural Information

Molecular Formula
C11H19NO4
SMILES
CCCCNC(=O)OCCOC(=O)C(=C)C
InChI
InChI=1S/C11H19NO4/c1-4-5-6-12-11(14)16-8-7-15-10(13)9(2)3/h2,4-8H2,1,3H3,(H,12,14)
InChIKey
DBONJWHQIKMBHG-UHFFFAOYSA-N
Compound name
2-(butylcarbamoyloxy)ethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

51
Patents

229.13141 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.13869 154.7
[M+Na]+ 252.12063 159.2
[M-H]- 228.12413 154.3
[M+NH4]+ 247.16523 172.3
[M+K]+ 268.09457 159.2
[M+H-H2O]+ 212.12867 148.7
[M+HCOO]- 274.12961 176.5
[M+CH3COO]- 288.14526 192.9
[M+Na-2H]- 250.10608 155.6
[M]+ 229.13086 158.5
[M]- 229.13196 158.5
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

patents stripe