CID 207693

30533-71-2

Structural Information

Molecular Formula
C15H20N2O2
SMILES
C=CCOC1=C(C=C(C=C1)N)C(=O)N2CCCCC2
InChI
InChI=1S/C15H20N2O2/c1-2-10-19-14-7-6-12(16)11-13(14)15(18)17-8-4-3-5-9-17/h2,6-7,11H,1,3-5,8-10,16H2
InChIKey
QSVABNAOBREGCO-UHFFFAOYSA-N
Compound name
(5-amino-2-prop-2-enoxyphenyl)-piperidin-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.15247 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.159746 162.0
[M+Na]+ 283.141688 166.4
[M-H]- 259.145194 165.9
[M+NH4]+ 278.186293 176.5
[M+K]+ 299.115628 162.7
[M+H-H2O]+ 243.149730 153.5
[M+HCOO]- 305.150671 180.6
[M+CH3COO]- 319.166321 197.9
[M+Na-2H]- 281.127136 163.3
[M]+ 260.15192142 157.5
[M]- 260.15301858 157.5
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.