CID 13217327

1h-pyrrolizine-7a(5h)-acetamide, tetrahydro-n-(2-chlorophenyl)-, monohydrochloride

Structural Information

Molecular Formula
C15H19ClN2O
SMILES
C1CC2(CCCN2C1)CC(=O)NC3=CC=CC=C3Cl
InChI
InChI=1S/C15H19ClN2O/c16-12-5-1-2-6-13(12)17-14(19)11-15-7-3-9-18(15)10-4-8-15/h1-2,5-6H,3-4,7-11H2,(H,17,19)
InChIKey
IVPPGGYGCPPBCQ-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)-2-(1,2,3,5,6,7-hexahydropyrrolizin-8-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

278.1186 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.12588 166.8
[M+Na]+ 301.10782 172.9
[M-H]- 277.11132 172.3
[M+NH4]+ 296.15242 188.0
[M+K]+ 317.08176 167.6
[M+H-H2O]+ 261.11586 159.9
[M+HCOO]- 323.11680 182.4
[M+CH3COO]- 337.13245 177.7
[M+Na-2H]- 299.09327 167.9
[M]+ 278.11805 164.8
[M]- 278.11915 164.8
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

No patent data available for this compound.