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7,7-Dichloro-3-hydroxy-6-(2',3',4'-trimethoxyphenyl)bicyclo[4.1.0]hept-3-en-2-one
SpectraBase Compound ID FkCtD7e9c8E
InChI InChI=1S/C16H16Cl2O5/c1-21-10-5-4-8(12(22-2)13(10)23-3)15-7-6-9(19)11(20)14(15)16(15,17)18/h4-6,14,19H,7H2,1-3H3
InChIKey NICVBBUZJMYJJR-UHFFFAOYSA-N
Mol Weight 359.21 g/mol
Molecular Formula C16H16Cl2O5
Exact Mass 358.037479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlSLPsL4hrm
Name 7,7-Dichloro-3-hydroxy-6-(2',3',4'-trimethoxyphenyl)bicyclo[4.1.0]hept-3-en-2-one
Alternate Name(s) 7,7-Dichloro-3-hydroxy-6-(2,3,4-trimethoxyphenyl)bicyclo[4.1.0]hept-3-en-2-one
CAS Registry Number 116211-72-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16Cl2O5
InChI InChI=1S/C16H16Cl2O5/c1-21-10-5-4-8(12(22-2)13(10)23-3)15-7-6-9(19)11(20)14(15)16(15,17)18/h4-6,14,19H,7H2,1-3H3
InChIKey NICVBBUZJMYJJR-UHFFFAOYSA-N
Molecular Weight 359.205 g/mol
SMILES OC1=CCC2(C(Cl)(Cl)C2C1=O)c1c(c(OC)c(cc1)OC)OC
SPLASH splash10-00di-0009000000-55363e59eed0b19351e3
Source of Spectrum J-53-4951-19
Wiley ID 1346827