CID 200678

2501-69-1

Structural Information

Molecular Formula
C20H23Cl2NO2
SMILES
C1COCCN1CCC(CC2=CC=CC=C2Cl)(C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C20H23Cl2NO2/c21-18-7-5-17(6-8-18)20(24,9-10-23-11-13-25-14-12-23)15-16-3-1-2-4-19(16)22/h1-8,24H,9-15H2
InChIKey
QAESGCBVZFLUBA-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)-2-(4-chlorophenyl)-4-morpholin-4-ylbutan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.1106 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.11788 189.1
[M+Na]+ 402.09982 194.2
[M-H]- 378.10332 194.5
[M+NH4]+ 397.14442 198.3
[M+K]+ 418.07376 187.9
[M+H-H2O]+ 362.10786 180.2
[M+HCOO]- 424.10880 193.7
[M+CH3COO]- 438.12445 211.6
[M+Na-2H]- 400.08527 191.6
[M]+ 379.11005 189.3
[M]- 379.11115 189.3
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.