CID 58721564

Schembl16230513

Structural Information

Molecular Formula
C11H20O3
SMILES
CC/C=C\CCC(CCCC(=O)O)O
InChI
InChI=1S/C11H20O3/c1-2-3-4-5-7-10(12)8-6-9-11(13)14/h3-4,10,12H,2,5-9H2,1H3,(H,13,14)/b4-3-
InChIKey
QDLWIXAPFWSJQX-ARJAWSKDSA-N
Compound name
(Z)-5-hydroxyundec-8-enoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

3
Patents

200.14125 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.148526 150.2
[M+Na]+ 223.130468 154.7
[M-H]- 199.133974 146.9
[M+NH4]+ 218.175073 168.0
[M+K]+ 239.104408 152.4
[M+H-H2O]+ 183.138510 145.2
[M+HCOO]- 245.139451 168.5
[M+CH3COO]- 259.155101 182.1
[M+Na-2H]- 221.115916 151.0
[M]+ 200.14070142 151.1
[M]- 200.14179858 151.1
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.