CID 118364436

Ethyl 2-(oxan-4-yl)prop-2-enoate

Structural Information

Molecular Formula
C10H16O3
SMILES
CCOC(=O)C(=C)C1CCOCC1
InChI
InChI=1S/C10H16O3/c1-3-13-10(11)8(2)9-4-6-12-7-5-9/h9H,2-7H2,1H3
InChIKey
YKAHDNDEFHHIKE-UHFFFAOYSA-N
Compound name
ethyl 2-(oxan-4-yl)prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

184.10994 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.11722 141.5
[M+Na]+ 207.09916 145.6
[M-H]- 183.10266 144.7
[M+NH4]+ 202.14376 159.6
[M+K]+ 223.07310 146.3
[M+H-H2O]+ 167.10720 135.7
[M+HCOO]- 229.10814 159.6
[M+CH3COO]- 243.12379 180.8
[M+Na-2H]- 205.08461 144.8
[M]+ 184.10939 139.7
[M]- 184.11049 139.7
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

patents stripe