CID 46839344

Pcmea

Structural Information

Molecular Formula
C15H23NO
SMILES
COCCNC1(CCCCC1)C2=CC=CC=C2
InChI
InChI=1S/C15H23NO/c1-17-13-12-16-15(10-6-3-7-11-15)14-8-4-2-5-9-14/h2,4-5,8-9,16H,3,6-7,10-13H2,1H3
InChIKey
MSZKHYPXVOHFEV-UHFFFAOYSA-N
Compound name
N-(2-methoxyethyl)-1-phenylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

20
Patents

233.17796 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.18524 157.7
[M+Na]+ 256.16718 169.2
[M+NH4]+ 251.21178 168.5
[M+K]+ 272.14112 158.9
[M-H]- 232.17068 163.0
[M+Na-2H]- 254.15263 167.2
[M]+ 233.17741 161.0
[M]- 233.17851 161.0
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