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Details

Stereochemistry MIXED
Molecular Formula C13H12F3NO
Molecular Weight 255.2357
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2,2-Trifluoro-1-(1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)ethan-1-one

SMILES

FC(F)(F)C(=O)N1CC2CC(C1)C3=C2C=CC=C3

InChI

InChIKey=LMOTUASGGOAXPT-UHFFFAOYSA-N
InChI=1S/C13H12F3NO/c14-13(15,16)12(18)17-6-8-5-9(7-17)11-4-2-1-3-10(8)11/h1-4,8-9H,5-7H2

HIDE SMILES / InChI

Approval Year

Name Type Language
1-(4,5-Dihydro-1H-1,5-methanobenzo[d]azepin-3(2H)-yl)-2,2,2-trifluoroethanone
Preferred Name English
2,2,2-Trifluoro-1-(1,2,4,5-tetrahydro-3H-1,5-methanobenzo[d]azepin-3-yl)ethan-1-one
Systematic Name English
2,2,2-Trifluoro-1-(1,2,4,5-tetrahydro-1,5-methano-3H-3-benzazepin-3-yl)ethanone
Systematic Name English
Ethanone, 2,2,2-trifluoro-1-(1,2,4,5-tetrahydro-1,5-methano-3H-3-benzazepin-3-yl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
21864732
Created by admin on Wed Apr 02 18:21:50 GMT 2025 , Edited by admin on Wed Apr 02 18:21:50 GMT 2025
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FDA UNII
YL8CQD7WCL
Created by admin on Wed Apr 02 18:21:50 GMT 2025 , Edited by admin on Wed Apr 02 18:21:50 GMT 2025
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CAS
230615-51-7
Created by admin on Wed Apr 02 18:21:50 GMT 2025 , Edited by admin on Wed Apr 02 18:21:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID30619028
Created by admin on Wed Apr 02 18:21:50 GMT 2025 , Edited by admin on Wed Apr 02 18:21:50 GMT 2025
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