CID 156588936

N-propionyl norfentanyl

Structural Information

Molecular Formula
C17H24N2O2
SMILES
CCC(=O)N1CCC(CC1)N(C2=CC=CC=C2)C(=O)CC
InChI
InChI=1S/C17H24N2O2/c1-3-16(20)18-12-10-15(11-13-18)19(17(21)4-2)14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3
InChIKey
YZEFBCDAONSYET-UHFFFAOYSA-N
Compound name
N-phenyl-N-(1-propanoylpiperidin-4-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.18378 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.191056 170.4
[M+Na]+ 311.172998 172.8
[M-H]- 287.176504 175.5
[M+NH4]+ 306.217603 184.2
[M+K]+ 327.146938 171.0
[M+H-H2O]+ 271.181040 161.2
[M+HCOO]- 333.181981 188.5
[M+CH3COO]- 347.197631 207.0
[M+Na-2H]- 309.158446 170.5
[M]+ 288.18323142 167.7
[M]- 288.18432858 167.7
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.