CID 15917060

87450-10-0

Structural Information

Molecular Formula
C11H20O5
SMILES
C#CCOCCOCCOCCOCCO
InChI
InChI=1S/C11H20O5/c1-2-4-13-6-8-15-10-11-16-9-7-14-5-3-12/h1,12H,3-11H2
InChIKey
WQMJFCWQBPUZCK-UHFFFAOYSA-N
Compound name
2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

154
Patents

232.13107 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.13835 145.0
[M+Na]+ 255.12029 152.2
[M-H]- 231.12379 142.7
[M+NH4]+ 250.16489 160.5
[M+K]+ 271.09423 151.3
[M+H-H2O]+ 215.12833 133.5
[M+HCOO]- 277.12927 161.8
[M+CH3COO]- 291.14492 195.3
[M+Na-2H]- 253.10574 149.3
[M]+ 232.13052 147.2
[M]- 232.13162 147.2
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.