CID 137700120

O-methyl cyclopropyl fentanyl

Structural Information

Molecular Formula
C24H30N2O
SMILES
CC1=CC=CC=C1N(C2CCN(CC2)CCC3=CC=CC=C3)C(=O)C4CC4
InChI
InChI=1S/C24H30N2O/c1-19-7-5-6-10-23(19)26(24(27)21-11-12-21)22-14-17-25(18-15-22)16-13-20-8-3-2-4-9-20/h2-10,21-22H,11-18H2,1H3
InChIKey
BFQXWRBDVXLPEX-UHFFFAOYSA-N
Compound name
N-(2-methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

362.2358 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.24308 187.0
[M+Na]+ 385.22502 190.3
[M-H]- 361.22852 197.9
[M+NH4]+ 380.26962 192.9
[M+K]+ 401.19896 185.7
[M+H-H2O]+ 345.23306 176.1
[M+HCOO]- 407.23400 205.5
[M+CH3COO]- 421.24965 195.1
[M+Na-2H]- 383.21047 187.0
[M]+ 362.23525 185.3
[M]- 362.23635 185.3
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.