CID 91864752

6-(benzyloxy)-1,2,3,4-tetrahydronaphthalen-2-amine

Structural Information

Molecular Formula
C17H19NO
SMILES
C1CC2=C(CC1N)C=CC(=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C17H19NO/c18-16-8-6-15-11-17(9-7-14(15)10-16)19-12-13-4-2-1-3-5-13/h1-5,7,9,11,16H,6,8,10,12,18H2
InChIKey
HVUBXTZKKMBOJG-UHFFFAOYSA-N
Compound name
6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.14667 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.153946 157.8
[M+Na]+ 276.135888 163.4
[M-H]- 252.139394 164.2
[M+NH4]+ 271.180493 175.0
[M+K]+ 292.109828 158.6
[M+H-H2O]+ 236.143930 149.7
[M+HCOO]- 298.144871 178.7
[M+CH3COO]- 312.160521 169.1
[M+Na-2H]- 274.121336 163.4
[M]+ 253.14612142 154.2
[M]- 253.14721858 154.2
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.