CID 5619

Talactoferrin alfa

Structural Information

Molecular Formula
C19H26Cl2N2O
SMILES
CN(C1CCCCC1N2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl
InChI
InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3
InChIKey
VQLPLYSROCPWFF-UHFFFAOYSA-N
Compound name
2-(3,4-dichlorophenyl)-N-methyl-N-(2-pyrrolidin-1-ylcyclohexyl)acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1752
References

669
Patents

368.1422 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.14948 186.4
[M+Na]+ 391.13142 198.0
[M+NH4]+ 386.17602 195.0
[M+K]+ 407.10536 191.3
[M-H]- 367.13492 191.8
[M+Na-2H]- 389.11687 192.4
[M]+ 368.14165 190.0
[M]- 368.14275 190.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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