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
4
Annotation Hits

0
References

37
Patents

350.20056 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.207836 185.4
[M+Na]+ 373.189778 187.3
[M-H]- 349.193284 187.7
[M+NH4]+ 368.234383 196.1
[M+K]+ 389.163718 184.4
[M+H-H2O]+ 333.197820 175.2
[M+HCOO]- 395.198761 200.4
[M+CH3COO]- 409.214411 216.4
[M+Na-2H]- 371.175226 182.8
[M]+ 350.20001142 182.3
[M]- 350.20110858 182.3
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

patents stripe