CID 4103062

3,6,9,12-tetraoxaoctadecanoicacid

Structural Information

Molecular Formula
C14H28O6
SMILES
CCCCCCOCCOCCOCCOCC(=O)O
InChI
InChI=1S/C14H28O6/c1-2-3-4-5-6-17-7-8-18-9-10-19-11-12-20-13-14(15)16/h2-13H2,1H3,(H,15,16)
InChIKey
CZCCHIDOMPOGLB-UHFFFAOYSA-N
Compound name
2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

476
Patents

292.1886 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.19588 170.5
[M+Na]+ 315.17782 176.7
[M+NH4]+ 310.22242 174.2
[M+K]+ 331.15176 172.1
[M-H]- 291.18132 166.6
[M+Na-2H]- 313.16327 169.7
[M]+ 292.18805 169.7
[M]- 292.18915 169.7
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

patents stripe