CID 2935759

618080-32-3

Structural Information

Molecular Formula
C16H19NO2
SMILES
CC1CCCN(C1)C(=O)C2=C(C3=CC=CC=C3O2)C
InChI
InChI=1S/C16H19NO2/c1-11-6-5-9-17(10-11)16(18)15-12(2)13-7-3-4-8-14(13)19-15/h3-4,7-8,11H,5-6,9-10H2,1-2H3
InChIKey
IUYWMKLVSKRXFD-UHFFFAOYSA-N
Compound name
(3-methyl-1-benzofuran-2-yl)-(3-methylpiperidin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.14157 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.14885 158.7
[M+Na]+ 280.13079 172.5
[M+NH4]+ 275.17539 167.5
[M+K]+ 296.10473 167.4
[M-H]- 256.13429 163.9
[M+Na-2H]- 278.11624 164.7
[M]+ 257.14102 162.2
[M]- 257.14212 162.2
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

No patent data available for this compound.