CID 113159

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

Structural Information

Molecular Formula
C10H17NO4
SMILES
CCCCNC(=O)OCCOC(=O)C=C
InChI
InChI=1S/C10H17NO4/c1-3-5-6-11-10(13)15-8-7-14-9(12)4-2/h4H,2-3,5-8H2,1H3,(H,11,13)
InChIKey
FLKHVLRENDBIDB-UHFFFAOYSA-N
Compound name
2-(butylcarbamoyloxy)ethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1062
Patents

215.11575 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 149.6
[M+Na]+ 238.10497 154.8
[M-H]- 214.10847 149.4
[M+NH4]+ 233.14957 167.9
[M+K]+ 254.07891 154.6
[M+H-H2O]+ 198.11301 143.7
[M+HCOO]- 260.11395 172.8
[M+CH3COO]- 274.12960 189.0
[M+Na-2H]- 236.09042 152.4
[M]+ 215.11520 153.8
[M]- 215.11630 153.8
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.