CID 3048077

2-methyl-1-(3-phenoxypropyl)piperidine

Structural Information

Molecular Formula
C15H23NO
SMILES
CC1CCCCN1CCCOC2=CC=CC=C2
InChI
InChI=1S/C15H23NO/c1-14-8-5-6-11-16(14)12-7-13-17-15-9-3-2-4-10-15/h2-4,9-10,14H,5-8,11-13H2,1H3
InChIKey
OTMLATMCCJDRRG-UHFFFAOYSA-N
Compound name
2-methyl-1-(3-phenoxypropyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

233.17796 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.18524 156.7
[M+Na]+ 256.16718 160.6
[M-H]- 232.17068 160.5
[M+NH4]+ 251.21178 172.7
[M+K]+ 272.14112 157.5
[M+H-H2O]+ 216.17522 148.0
[M+HCOO]- 278.17616 175.2
[M+CH3COO]- 292.19181 191.8
[M+Na-2H]- 254.15263 160.4
[M]+ 233.17741 154.0
[M]- 233.17851 154.0
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

patents stripe