CID 46451

1-naphthylamine, 1,2,3,4-tetrahydro-7,8-dimethoxy-n-methyl-, hydrochloride

Structural Information

Molecular Formula
C13H19NO2
SMILES
CNC1CCCC2=C1C(=C(C=C2)OC)OC
InChI
InChI=1S/C13H19NO2/c1-14-10-6-4-5-9-7-8-11(15-2)13(16-3)12(9)10/h7-8,10,14H,4-6H2,1-3H3
InChIKey
UQRPQQOZODJFET-UHFFFAOYSA-N
Compound name
7,8-dimethoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.14159 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.14887 148.8
[M+Na]+ 244.13081 155.7
[M-H]- 220.13431 153.1
[M+NH4]+ 239.17541 168.5
[M+K]+ 260.10475 153.5
[M+H-H2O]+ 204.13885 142.4
[M+HCOO]- 266.13979 170.5
[M+CH3COO]- 280.15544 193.9
[M+Na-2H]- 242.11626 154.4
[M]+ 221.14104 149.3
[M]- 221.14214 149.3
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.