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]+ 261.196146 163.9
[M+Na]+ 283.178088 167.2
[M-H]- 259.181594 165.4
[M+NH4]+ 278.222693 177.6
[M+K]+ 299.152028 162.3
[M+H-H2O]+ 243.186130 154.3
[M+HCOO]- 305.187071 176.1
[M+CH3COO]- 319.202721 172.4
[M+Na-2H]- 281.163536 166.9
[M]+ 260.18832142 156.4
[M]- 260.18941858 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.