CID 21504945

Schembl14876693

Structural Information

Molecular Formula
C15H29NO3
SMILES
CCCCCCCC/C=C/C(=O)N(CCO)CCO
InChI
InChI=1S/C15H29NO3/c1-2-3-4-5-6-7-8-9-10-15(19)16(11-13-17)12-14-18/h9-10,17-18H,2-8,11-14H2,1H3/b10-9+
InChIKey
LACWVMIHIJKPTF-MDZDMXLPSA-N
Compound name
(E)-N,N-bis(2-hydroxyethyl)undec-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

271.21475 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.222026 171.9
[M+Na]+ 294.203968 174.2
[M-H]- 270.207474 169.1
[M+NH4]+ 289.248573 187.2
[M+K]+ 310.177908 171.8
[M+H-H2O]+ 254.212010 165.2
[M+HCOO]- 316.212951 191.3
[M+CH3COO]- 330.228601 201.0
[M+Na-2H]- 292.189416 171.3
[M]+ 271.21420142 175.2
[M]- 271.21529858 175.2
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