CID 176472655

2-[2,2-bis(prop-2-enoxymethyl)butoxymethyl]oxirane

Structural Information

Molecular Formula
C15H26O4
SMILES
CCC(COCC=C)(COCC=C)COCC1CO1
InChI
InChI=1S/C15H26O4/c1-4-7-16-11-15(6-3,12-17-8-5-2)13-18-9-14-10-19-14/h4-5,14H,1-2,6-13H2,3H3
InChIKey
YKWMALDIQSRSNO-UHFFFAOYSA-N
Compound name
2-[2,2-bis(prop-2-enoxymethyl)butoxymethyl]oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.1831 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.190376 167.4
[M+Na]+ 293.172318 173.9
[M-H]- 269.175824 171.5
[M+NH4]+ 288.216923 178.0
[M+K]+ 309.146258 171.9
[M+H-H2O]+ 253.180360 160.4
[M+HCOO]- 315.181301 187.3
[M+CH3COO]- 329.196951 201.7
[M+Na-2H]- 291.157766 172.2
[M]+ 270.18255142 177.7
[M]- 270.18364858 177.7
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.