CID 207703

30533-82-5

Structural Information

Molecular Formula
C15H20N2O2
SMILES
CCCCCNC(=O)C1=C(C=CC(=C1)N)OCC#C
InChI
InChI=1S/C15H20N2O2/c1-3-5-6-9-17-15(18)13-11-12(16)7-8-14(13)19-10-4-2/h2,7-8,11H,3,5-6,9-10,16H2,1H3,(H,17,18)
InChIKey
UQFPCYPXSIRWKC-UHFFFAOYSA-N
Compound name
5-amino-N-pentyl-2-prop-2-ynoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.15247 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.15975 163.2
[M+Na]+ 283.14169 172.7
[M+NH4]+ 278.18629 166.1
[M+K]+ 299.11563 163.5
[M-H]- 259.14519 157.0
[M+Na-2H]- 281.12714 164.4
[M]+ 260.15192 161.7
[M]- 260.15302 161.7
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.