CID 23635243

2-(decylamino)tetralin-6-ol

Structural Information

Molecular Formula
C20H33NO
SMILES
CCCCCCCCCCNC1CCC2=C(C1)C=CC(=C2)O
InChI
InChI=1S/C20H33NO/c1-2-3-4-5-6-7-8-9-14-21-19-12-10-18-16-20(22)13-11-17(18)15-19/h11,13,16,19,21-22H,2-10,12,14-15H2,1H3
InChIKey
DPZNGUAVFIPBGZ-UHFFFAOYSA-N
Compound name
6-(decylamino)-5,6,7,8-tetrahydronaphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

303.25623 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.26351 177.7
[M+Na]+ 326.24545 180.2
[M-H]- 302.24895 178.8
[M+NH4]+ 321.29005 192.9
[M+K]+ 342.21939 174.8
[M+H-H2O]+ 286.25349 170.1
[M+HCOO]- 348.25443 195.2
[M+CH3COO]- 362.27008 209.2
[M+Na-2H]- 324.23090 179.7
[M]+ 303.25568 176.9
[M]- 303.25678 176.9
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

No patent data available for this compound.