CID 44721

63766-13-2

Structural Information

Molecular Formula
C14H21NO2
SMILES
CN(C)C(C1CCCC2=C1C=CC=C2OC)O
InChI
InChI=1S/C14H21NO2/c1-15(2)14(16)12-8-4-7-11-10(12)6-5-9-13(11)17-3/h5-6,9,12,14,16H,4,7-8H2,1-3H3
InChIKey
RBJSINFKPKTNED-UHFFFAOYSA-N
Compound name
dimethylamino-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.15723 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.164506 154.2
[M+Na]+ 258.146448 159.1
[M-H]- 234.149954 158.1
[M+NH4]+ 253.191053 172.8
[M+K]+ 274.120388 157.8
[M+H-H2O]+ 218.154490 147.7
[M+HCOO]- 280.155431 173.5
[M+CH3COO]- 294.171081 197.5
[M+Na-2H]- 256.131896 157.5
[M]+ 235.15668142 153.5
[M]- 235.15777858 153.5
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.