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Endo-1-chloro-8-phenyl-8,10-diazatricyclo[5.2.2.0(2,6)]undecane-9,11-dione
SpectraBase Compound ID 5m1Sk0KgonN
InChI InChI=1S/C15H15ClN2O2/c16-15-11-8-4-7-10(11)12(13(19)17-15)18(14(15)20)9-5-2-1-3-6-9/h1-3,5-6,10-12H,4,7-8H2,(H,17,19)/t10?,11?,12-,15-/m0/s1
InChIKey ZHYYBKQKIYEQGI-UFDFEIGVSA-N
Mol Weight 290.75 g/mol
Molecular Formula C15H15ClN2O2
Exact Mass 290.082205 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ks29P1l9Ycw
Name Endo-1-chloro-8-phenyl-8,10-diazatricyclo[5.2.2.0(2,6)]undecane-9,11-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.082205429 u
Formula C15H15ClN2O2
InChI InChI=1S/C15H15ClN2O2/c16-15-11-8-4-7-10(11)12(13(19)17-15)18(14(15)20)9-5-2-1-3-6-9/h1-3,5-6,10-12H,4,7-8H2,(H,17,19)/t10?,11?,12-,15-/m0/s1
InChIKey ZHYYBKQKIYEQGI-UFDFEIGVSA-N
SMILES [C@@]12(C3CCCC3[C@](N(C1=O)C=1C=CC=CC1)(C(N2)=O)[H])Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928661