CID 58940

1-cyclopropylmethyl-2-skatylpiperidine

Structural Information

Molecular Formula
C18H24N2
SMILES
C1CCN(C(C1)CC2=CNC3=CC=CC=C32)CC4CC4
InChI
InChI=1S/C18H24N2/c1-2-7-18-17(6-1)15(12-19-18)11-16-5-3-4-10-20(16)13-14-8-9-14/h1-2,6-7,12,14,16,19H,3-5,8-11,13H2
InChIKey
VNXWGWDOMOQJEZ-UHFFFAOYSA-N
Compound name
3-[[1-(cyclopropylmethyl)piperidin-2-yl]methyl]-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.19394 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.20122 165.1
[M+Na]+ 291.18316 172.7
[M-H]- 267.18666 171.2
[M+NH4]+ 286.22776 175.9
[M+K]+ 307.15710 165.7
[M+H-H2O]+ 251.19120 156.0
[M+HCOO]- 313.19214 182.3
[M+CH3COO]- 327.20779 174.9
[M+Na-2H]- 289.16861 167.4
[M]+ 268.19339 163.0
[M]- 268.19449 163.0
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.