CID 154267

27306-90-7

Structural Information

Molecular Formula
C16H32O4
SMILES
CCCCCCCCCCCCOCCOCC(=O)O
InChI
InChI=1S/C16H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-19-13-14-20-15-16(17)18/h2-15H2,1H3,(H,17,18)
InChIKey
OUNZARDETXBPIX-UHFFFAOYSA-N
Compound name
2-(2-dodecoxyethoxy)acetic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

3160
Patents

288.23007 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.23735 175.6
[M+Na]+ 311.21929 178.2
[M-H]- 287.22279 172.6
[M+NH4]+ 306.26389 190.5
[M+K]+ 327.19323 176.2
[M+H-H2O]+ 271.22733 168.9
[M+HCOO]- 333.22827 194.8
[M+CH3COO]- 347.24392 202.3
[M+Na-2H]- 309.20474 175.7
[M]+ 288.22952 183.3
[M]- 288.23062 183.3
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

No patent data available for this compound.