CID 16773905

1170882-91-3

Structural Information

Molecular Formula
C12H20N2O2
SMILES
CN(C)CCOC1=C(C=C(C=C1)CN)OC
InChI
InChI=1S/C12H20N2O2/c1-14(2)6-7-16-11-5-4-10(9-13)8-12(11)15-3/h4-5,8H,6-7,9,13H2,1-3H3
InChIKey
NVNKSCOESHKPSQ-UHFFFAOYSA-N
Compound name
2-[4-(aminomethyl)-2-methoxyphenoxy]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.15248 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.159756 152.2
[M+Na]+ 247.141698 158.5
[M-H]- 223.145204 156.7
[M+NH4]+ 242.186303 170.7
[M+K]+ 263.115638 157.9
[M+H-H2O]+ 207.149740 145.0
[M+HCOO]- 269.150681 178.1
[M+CH3COO]- 283.166331 199.4
[M+Na-2H]- 245.127146 156.1
[M]+ 224.15193142 155.6
[M]- 224.15302858 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.