CID 13394779

N-(n-methylcarbamoyloxy)fenfluramine

Structural Information

Molecular Formula
C14H19F3N2O2
SMILES
CCN(C(C)CC1=CC(=CC=C1)C(F)(F)F)OC(=O)NC
InChI
InChI=1S/C14H19F3N2O2/c1-4-19(21-13(20)18-3)10(2)8-11-6-5-7-12(9-11)14(15,16)17/h5-7,9-10H,4,8H2,1-3H3,(H,18,20)
InChIKey
TVBMUKOENJHCQD-UHFFFAOYSA-N
Compound name
[ethyl-[1-[3-(trifluoromethyl)phenyl]propan-2-yl]amino] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.13986 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.14714 169.0
[M+Na]+ 327.12908 174.0
[M-H]- 303.13258 169.6
[M+NH4]+ 322.17368 184.0
[M+K]+ 343.10302 172.9
[M+H-H2O]+ 287.13712 159.1
[M+HCOO]- 349.13806 188.3
[M+CH3COO]- 363.15371 212.2
[M+Na-2H]- 325.11453 170.1
[M]+ 304.13931 167.4
[M]- 304.14041 167.4
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.