CID 210729

Piperazine, 4-methyl-1-(1-phenylcyclohexyl)-, hydrochloride

Structural Information

Molecular Formula
C17H26N2
SMILES
CN1CCN(CC1)C2(CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C17H26N2/c1-18-12-14-19(15-13-18)17(10-6-3-7-11-17)16-8-4-2-5-9-16/h2,4-5,8-9H,3,6-7,10-15H2,1H3
InChIKey
OYUCDSLJJSMPAE-UHFFFAOYSA-N
Compound name
1-methyl-4-(1-phenylcyclohexyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.2096 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.21688 165.8
[M+Na]+ 281.19882 168.1
[M-H]- 257.20232 170.6
[M+NH4]+ 276.24342 180.7
[M+K]+ 297.17276 164.0
[M+H-H2O]+ 241.20686 155.0
[M+HCOO]- 303.20780 179.1
[M+CH3COO]- 317.22345 174.5
[M+Na-2H]- 279.18427 168.5
[M]+ 258.20905 156.1
[M]- 258.21015 156.1
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.