CID 138039409

2-[(2-cyclopropylphenyl)methyl]piperidine

Structural Information

Molecular Formula
C15H21N
SMILES
C1CCNC(C1)CC2=CC=CC=C2C3CC3
InChI
InChI=1S/C15H21N/c1-2-7-15(12-8-9-12)13(5-1)11-14-6-3-4-10-16-14/h1-2,5,7,12,14,16H,3-4,6,8-11H2
InChIKey
WRXUPQOJTMDJGD-UHFFFAOYSA-N
Compound name
2-[(2-cyclopropylphenyl)methyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.1674 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.174676 149.8
[M+Na]+ 238.156618 155.5
[M-H]- 214.160124 156.2
[M+NH4]+ 233.201223 161.2
[M+K]+ 254.130558 150.8
[M+H-H2O]+ 198.164660 141.4
[M+HCOO]- 260.165601 167.7
[M+CH3COO]- 274.181251 160.2
[M+Na-2H]- 236.142066 153.8
[M]+ 215.16685142 145.2
[M]- 215.16794858 145.2
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.