CID 118209

35067-60-8

Structural Information

Molecular Formula
C15H21N
SMILES
C=CCN1CCCCC1CC2=CC=CC=C2
InChI
InChI=1S/C15H21N/c1-2-11-16-12-7-6-10-15(16)13-14-8-4-3-5-9-14/h2-5,8-9,15H,1,6-7,10-13H2
InChIKey
ZVVRTPHRMJVLOU-UHFFFAOYSA-N
Compound name
2-benzyl-1-prop-2-enylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

5
Patents

215.1674 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.17468 152.0
[M+Na]+ 238.15662 156.3
[M-H]- 214.16012 155.9
[M+NH4]+ 233.20122 168.8
[M+K]+ 254.13056 152.1
[M+H-H2O]+ 198.16466 143.7
[M+HCOO]- 260.16560 170.6
[M+CH3COO]- 274.18125 189.0
[M+Na-2H]- 236.14207 155.8
[M]+ 215.16685 147.2
[M]- 215.16795 147.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe