CID 93675

57454-26-9

Structural Information

Molecular Formula
C13H24O6
SMILES
CC(=C)C(=O)OCCOCCOCCOCCOC
InChI
InChI=1S/C13H24O6/c1-12(2)13(14)19-11-10-18-9-8-17-7-6-16-5-4-15-3/h1,4-11H2,2-3H3
InChIKey
KRCGBOKYIUDIFY-UHFFFAOYSA-N
Compound name
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

530
Patents

276.1573 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.164576 165.2
[M+Na]+ 299.146518 169.4
[M-H]- 275.150024 164.3
[M+NH4]+ 294.191123 181.1
[M+K]+ 315.120458 170.1
[M+H-H2O]+ 259.154560 158.7
[M+HCOO]- 321.155501 186.6
[M+CH3COO]- 335.171151 199.3
[M+Na-2H]- 297.131966 166.4
[M]+ 276.15675142 175.2
[M]- 276.15784858 175.2
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