CID 106479

2-(2-hydroxyethylamino)ethyl 10-undecylenate

Structural Information

Molecular Formula
C15H29NO3
SMILES
C=CCCCCCCCCC(=O)OCCNCCO
InChI
InChI=1S/C15H29NO3/c1-2-3-4-5-6-7-8-9-10-15(18)19-14-12-16-11-13-17/h2,16-17H,1,3-14H2
InChIKey
QGUJFAXHAPVMQZ-UHFFFAOYSA-N
Compound name
2-(2-hydroxyethylamino)ethyl undec-10-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.21475 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.22203 169.9
[M+Na]+ 294.20397 176.1
[M+NH4]+ 289.24857 174.5
[M+K]+ 310.17791 169.9
[M-H]- 270.20747 167.5
[M+Na-2H]- 292.18942 169.8
[M]+ 271.21420 169.5
[M]- 271.21530 169.5
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.