CID 547115

2970-99-2

Structural Information

Molecular Formula
C11H17NO2
SMILES
CN(C)CC(C1=CC=C(C=C1)OC)O
InChI
InChI=1S/C11H17NO2/c1-12(2)8-11(13)9-4-6-10(14-3)7-5-9/h4-7,11,13H,8H2,1-3H3
InChIKey
UWKIAYYRGPTMIS-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-1-(4-methoxyphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

195.12593 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.133206 144.1
[M+Na]+ 218.115148 150.2
[M-H]- 194.118654 147.8
[M+NH4]+ 213.159753 163.4
[M+K]+ 234.089088 149.8
[M+H-H2O]+ 178.123190 137.8
[M+HCOO]- 240.124131 167.5
[M+CH3COO]- 254.139781 189.1
[M+Na-2H]- 216.100596 148.3
[M]+ 195.12538142 146.0
[M]- 195.12647858 146.0
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

patents stripe