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Heptabarbital

View entire compound with spectra: 1 NMR, 2 FTIR, 1 Raman, and 18 MS (GC)

Heptabarbital
SpectraBase Compound ID A2vxXSayUqN
InChI InChI=1S/C13H18N2O3/c1-2-13(9-7-5-3-4-6-8-9)10(16)14-12(18)15-11(13)17/h7H,2-6,8H2,1H3,(H2,14,15,16,17,18)
InChIKey PAZQYDJGLKSCSI-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C13H18N2O3
Exact Mass 250.131742 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 8NZV9iw2SxG
Name HEPTABARBITAL
Source of Sample Geigy Chemical Corporation
CAS Registry Number 509-86-4
Chemical Description 5-(1-CYCLOHEPTEN-1-YL)-5-ETHYLBARBITURIC ACID; 5-(1-CYCLOHEPTEN-1-YL)-5-ETHYL-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE
Compound Type Pure
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O3
InChI InChI=1S/C13H18N2O3/c1-2-13(9-7-5-3-4-6-8-9)10(16)14-12(18)15-11(13)17/h7H,2-6,8H2,1H3,(H2,14,15,16,17,18)
InChIKey PAZQYDJGLKSCSI-UHFFFAOYSA-N
Molecular Weight 250.29
Synonyms MEDOMIN HEPTADORM
Technique KBr WAFER
Use SEDATIVE; HYPNOTIC