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4-Heptenoic acid, 5-chloro-4-(phenylseleno)-, (E)-
SpectraBase Compound ID Bq2TP3l9MHh
InChI InChI=1S/C13H15ClO2Se/c1-2-11(14)12(8-9-13(15)16)17-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,15,16)/b12-11+
InChIKey HLROMIBNSBLNJH-VAWYXSNFSA-N
Mol Weight 317.69 g/mol
Molecular Formula C13H15ClO2Se
Exact Mass 317.992579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEbjaSLMfT4
Name 4-Heptenoic acid, 5-chloro-4-(phenylseleno)-, (E)-
Alternate Name(s) (4E)-5-chloro-4-(phenylselanyl)-4-heptenoic acid (E)-5-Chloro-4-phenylselenohept-4-enoic acid
CAS Registry Number 109574-10-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClO2Se
InChI InChI=1S/C13H15ClO2Se/c1-2-11(14)12(8-9-13(15)16)17-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,15,16)/b12-11+
InChIKey HLROMIBNSBLNJH-VAWYXSNFSA-N
Molecular Weight 317.686 g/mol
SMILES OC(CC\C([Se]c1ccccc1)=C\(Cl)CC)=O
SPLASH splash10-0a4i-0903000000-9dead85b951131c9b396
Source of Spectrum KC-1986-2002-0
Wiley ID 1318021