CID 121243

Brn 1022628

Structural Information

Molecular Formula
C19H30N2O3
SMILES
CN(C)CCOC1=C(C=C(C=C1OC)CC=C)CN2CCOCC2
InChI
InChI=1S/C19H30N2O3/c1-5-6-16-13-17(15-21-8-10-23-11-9-21)19(18(14-16)22-4)24-12-7-20(2)3/h5,13-14H,1,6-12,15H2,2-4H3
InChIKey
MANMSXDEJSQWQC-UHFFFAOYSA-N
Compound name
2-[2-methoxy-6-(morpholin-4-ylmethyl)-4-prop-2-enylphenoxy]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.22565 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.232926 184.5
[M+Na]+ 357.214868 188.0
[M-H]- 333.218374 190.4
[M+NH4]+ 352.259473 195.8
[M+K]+ 373.188808 186.8
[M+H-H2O]+ 317.222910 174.6
[M+HCOO]- 379.223851 202.9
[M+CH3COO]- 393.239501 217.9
[M+Na-2H]- 355.200316 185.2
[M]+ 334.22510142 187.4
[M]- 334.22619858 187.4
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.