CID 103015

Trimethylolpropane triglycidyl ether

Structural Information

Molecular Formula
C15H26O6
SMILES
CCC(COCC1CO1)(COCC2CO2)COCC3CO3
InChI
InChI=1S/C15H26O6/c1-2-15(9-16-3-12-6-19-12,10-17-4-13-7-20-13)11-18-5-14-8-21-14/h12-14H,2-11H2,1H3
InChIKey
QECCQGLIYMMHCR-UHFFFAOYSA-N
Compound name
2-[2,2-bis(oxiran-2-ylmethoxymethyl)butoxymethyl]oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

15804
Patents

302.17294 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.18022 184.5
[M+Na]+ 325.16216 186.3
[M-H]- 301.16566 192.8
[M+NH4]+ 320.20676 180.8
[M+K]+ 341.13610 190.2
[M+H-H2O]+ 285.17020 177.9
[M+HCOO]- 347.17114 194.9
[M+CH3COO]- 361.18679 220.7
[M+Na-2H]- 323.14761 185.4
[M]+ 302.17239 195.3
[M]- 302.17349 195.3
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