CID 3079191

Alpha-(2-(4-chlorophenyl)-2-hydroxyethyl)-1-pyrrolidinepropanoic acid hydrazide

Structural Information

Molecular Formula
C15H22ClN3O2
SMILES
C1CCN(C1)CC(CC(C2=CC=C(C=C2)Cl)O)C(=O)NN
InChI
InChI=1S/C15H22ClN3O2/c16-13-5-3-11(4-6-13)14(20)9-12(15(21)18-17)10-19-7-1-2-8-19/h3-6,12,14,20H,1-2,7-10,17H2,(H,18,21)
InChIKey
PQHXRQWIFPWMIN-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)-4-hydroxy-2-(pyrrolidin-1-ylmethyl)butanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.14005 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.14733 174.0
[M+Na]+ 334.12927 176.8
[M-H]- 310.13277 176.5
[M+NH4]+ 329.17387 187.7
[M+K]+ 350.10321 172.2
[M+H-H2O]+ 294.13731 166.3
[M+HCOO]- 356.13825 187.6
[M+CH3COO]- 370.15390 205.3
[M+Na-2H]- 332.11472 171.8
[M]+ 311.13950 170.3
[M]- 311.14060 170.3
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.