CID 104596

Tetraethylene oxide monocresylate

Structural Information

Molecular Formula
C15H24O5
SMILES
CC1=CC=C(C=C1)OCCOCCOCCOCCO
InChI
InChI=1S/C15H24O5/c1-14-2-4-15(5-3-14)20-13-12-19-11-10-18-9-8-17-7-6-16/h2-5,16H,6-13H2,1H3
InChIKey
ZYOIAYZVRHEJGD-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

284.16238 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.16966 166.5
[M+Na]+ 307.15160 171.4
[M-H]- 283.15510 167.7
[M+NH4]+ 302.19620 181.5
[M+K]+ 323.12554 169.8
[M+H-H2O]+ 267.15964 159.0
[M+HCOO]- 329.16058 188.6
[M+CH3COO]- 343.17623 198.0
[M+Na-2H]- 305.13705 170.4
[M]+ 284.16183 174.3
[M]- 284.16293 174.3
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