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]+ 279.125876 166.8
[M+Na]+ 301.107818 172.9
[M-H]- 277.111324 172.3
[M+NH4]+ 296.152423 188.0
[M+K]+ 317.081758 167.6
[M+H-H2O]+ 261.115860 159.9
[M+HCOO]- 323.116801 182.4
[M+CH3COO]- 337.132451 177.7
[M+Na-2H]- 299.093266 167.9
[M]+ 278.11805142 164.8
[M]- 278.11914858 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.