CID 5312746

10-hydroxy-11-dodecenoic acid

Structural Information

Molecular Formula
C12H22O3
SMILES
C=CC(CCCCCCCCC(=O)O)O
InChI
InChI=1S/C12H22O3/c1-2-11(13)9-7-5-3-4-6-8-10-12(14)15/h2,11,13H,1,3-10H2,(H,14,15)
InChIKey
MEUHQOZYCJHRAS-UHFFFAOYSA-N
Compound name
10-hydroxydodec-11-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.15689 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.16417 154.5
[M+Na]+ 237.14611 158.5
[M-H]- 213.14961 151.0
[M+NH4]+ 232.19071 171.7
[M+K]+ 253.12005 156.0
[M+H-H2O]+ 197.15415 149.3
[M+HCOO]- 259.15509 172.4
[M+CH3COO]- 273.17074 185.8
[M+Na-2H]- 235.13156 154.8
[M]+ 214.15634 155.9
[M]- 214.15744 155.9
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.