CID 30659

21489-52-1

Structural Information

Molecular Formula
C14H21NO2
SMILES
CN(C)C1CCC2=C(C1)C=CC(=C2OC)OC
InChI
InChI=1S/C14H21NO2/c1-15(2)11-6-7-12-10(9-11)5-8-13(16-3)14(12)17-4/h5,8,11H,6-7,9H2,1-4H3
InChIKey
RQWDWCITECNVBB-UHFFFAOYSA-N
Compound name
5,6-dimethoxy-N,N-dimethyl-1,2,3,4-tetrahydronaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.15723 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.16451 153.4
[M+Na]+ 258.14645 160.0
[M-H]- 234.14995 159.1
[M+NH4]+ 253.19105 173.2
[M+K]+ 274.12039 159.0
[M+H-H2O]+ 218.15449 146.7
[M+HCOO]- 280.15543 175.2
[M+CH3COO]- 294.17108 200.4
[M+Na-2H]- 256.13190 157.7
[M]+ 235.15668 155.6
[M]- 235.15778 155.6
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.