CID 208840

Dimeprozan

Structural Information

Molecular Formula
C19H21NO2
SMILES
CN(C)CCC=C1C2=CC=CC=C2OC3=C1C=C(C=C3)OC
InChI
InChI=1S/C19H21NO2/c1-20(2)12-6-8-15-16-7-4-5-9-18(16)22-19-11-10-14(21-3)13-17(15)19/h4-5,7-11,13H,6,12H2,1-3H3
InChIKey
CVEKPEDQESUNSP-UHFFFAOYSA-N
Compound name
3-(2-methoxyxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

295.15723 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.164506 170.1
[M+Na]+ 318.146448 177.3
[M-H]- 294.149954 177.1
[M+NH4]+ 313.191053 186.8
[M+K]+ 334.120388 174.6
[M+H-H2O]+ 278.154490 161.9
[M+HCOO]- 340.155431 190.6
[M+CH3COO]- 354.171081 211.2
[M+Na-2H]- 316.131896 176.4
[M]+ 295.15668142 173.8
[M]- 295.15777858 173.8
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.