CID 11971449

1-piperazineethanol, 4-(5,6,7,8-tetrahydro-1-naphthyl)-

Structural Information

Molecular Formula
C16H24N2O
SMILES
C1CCC2=C(C1)C=CC=C2N3CCN(CC3)CCO
InChI
InChI=1S/C16H24N2O/c19-13-12-17-8-10-18(11-9-17)16-7-3-5-14-4-1-2-6-15(14)16/h3,5,7,19H,1-2,4,6,8-13H2
InChIKey
PCUCQCHEUASHEV-UHFFFAOYSA-N
Compound name
2-[4-(5,6,7,8-tetrahydronaphthalen-1-yl)piperazin-1-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.18887 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.19615 163.9
[M+Na]+ 283.17809 167.2
[M-H]- 259.18159 165.4
[M+NH4]+ 278.22269 177.6
[M+K]+ 299.15203 162.3
[M+H-H2O]+ 243.18613 154.3
[M+HCOO]- 305.18707 176.1
[M+CH3COO]- 319.20272 172.4
[M+Na-2H]- 281.16354 166.9
[M]+ 260.18832 156.4
[M]- 260.18942 156.4
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.