CID 214244

27922-29-8

Structural Information

Molecular Formula
C15H19NO
SMILES
CC1=CC2=C(C=C1)C(=O)CC2N3CCCCC3
InChI
InChI=1S/C15H19NO/c1-11-5-6-12-13(9-11)14(10-15(12)17)16-7-3-2-4-8-16/h5-6,9,14H,2-4,7-8,10H2,1H3
InChIKey
MEJMCWUVTIQPHV-UHFFFAOYSA-N
Compound name
5-methyl-3-piperidin-1-yl-2,3-dihydroinden-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.14667 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.15395 154.1
[M+Na]+ 252.13589 166.7
[M+NH4]+ 247.18049 163.8
[M+K]+ 268.10983 160.5
[M-H]- 228.13939 158.3
[M+Na-2H]- 250.12134 159.8
[M]+ 229.14612 157.1
[M]- 229.14722 157.1
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.