CID 30429

Carperone

Structural Information

Molecular Formula
C19H27FN2O3
SMILES
CC(C)NC(=O)OC1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C19H27FN2O3/c1-14(2)21-19(24)25-17-9-12-22(13-10-17)11-3-4-18(23)15-5-7-16(20)8-6-15/h5-8,14,17H,3-4,9-13H2,1-2H3,(H,21,24)
InChIKey
HJSFDYCHYVGVDC-UHFFFAOYSA-N
Compound name
[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl] N-propan-2-ylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

350.20056 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.20784 186.0
[M+Na]+ 373.18978 193.8
[M+NH4]+ 368.23438 190.7
[M+K]+ 389.16372 188.5
[M-H]- 349.19328 186.5
[M+Na-2H]- 371.17523 188.9
[M]+ 350.20001 186.7
[M]- 350.20111 186.7
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

patents stripe