CID 137700045

Para-methyl cyclopropyl fentanyl

Structural Information

Molecular Formula
C24H30N2O
SMILES
CC1=CC=C(C=C1)N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)C4CC4
InChI
InChI=1S/C24H30N2O/c1-19-7-11-22(12-8-19)26(24(27)21-9-10-21)23-14-17-25(18-15-23)16-13-20-5-3-2-4-6-20/h2-8,11-12,21,23H,9-10,13-18H2,1H3
InChIKey
HVDSXTDEYBCMRJ-UHFFFAOYSA-N
Compound name
N-(4-methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

362.2358 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.24308 191.0
[M+Na]+ 385.22502 205.5
[M+NH4]+ 380.26962 200.0
[M+K]+ 401.19896 197.9
[M-H]- 361.22852 205.8
[M+Na-2H]- 383.21047 203.0
[M]+ 362.23525 198.5
[M]- 362.23635 198.5
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.