CID 11380684

862896-30-8

Structural Information

Molecular Formula
C17H24N2O2
SMILES
C1CC2CN(CC2C1)CCCOC3=CC=C(C=C3)C(=O)N
InChI
InChI=1S/C17H24N2O2/c18-17(20)13-5-7-16(8-6-13)21-10-2-9-19-11-14-3-1-4-15(14)12-19/h5-8,14-15H,1-4,9-12H2,(H2,18,20)
InChIKey
MRNMYWNBLVJWKG-UHFFFAOYSA-N
Compound name
4-[3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)propoxy]benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

5
References

73
Patents

288.18378 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.19106 170.0
[M+Na]+ 311.17300 174.0
[M-H]- 287.17650 174.8
[M+NH4]+ 306.21760 187.8
[M+K]+ 327.14694 170.3
[M+H-H2O]+ 271.18104 162.2
[M+HCOO]- 333.18198 189.0
[M+CH3COO]- 347.19763 203.0
[M+Na-2H]- 309.15845 168.2
[M]+ 288.18323 167.3
[M]- 288.18433 167.3
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

patents stripe