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]+ 335.23293 184.5
[M+Na]+ 357.21487 188.0
[M-H]- 333.21837 190.4
[M+NH4]+ 352.25947 195.8
[M+K]+ 373.18881 186.8
[M+H-H2O]+ 317.22291 174.6
[M+HCOO]- 379.22385 202.9
[M+CH3COO]- 393.23950 217.9
[M+Na-2H]- 355.20032 185.2
[M]+ 334.22510 187.4
[M]- 334.22620 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.