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EUTYPINE;4-HYDROXY-3-(3-METHYLBUT-3-EN-1-YNYL)-BENZALDEHYDE
SpectraBase Compound ID 2xDWQQRatE8
InChI InChI=1S/C12H10O2/c1-9(2)3-5-11-7-10(8-13)4-6-12(11)14/h4,6-8,14H,1H2,2H3
InChIKey SFCYVTIQMNZUCZ-UHFFFAOYSA-N
Mol Weight 186.21 g/mol
Molecular Formula C12H10O2
Exact Mass 186.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNmH1wf6HZd
Name 3-(3-Methylbut-3-en-1-ynyl)-4-oxidanyl-benzaldehyde
Alternate Name(s) 4-Hydroxy-3-(3-methyl-3-butene-1-ynyl)benzaldehyde 4-Hydroxy-3-(3-methylbut-3-en-1-ynyl)benzaldehyde Eutypine
CAS Registry Number 121007-17-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O2
InChI InChI=1S/C12H10O2/c1-9(2)3-5-11-7-10(8-13)4-6-12(11)14/h4,6-8,14H,1H2,2H3
InChIKey SFCYVTIQMNZUCZ-UHFFFAOYSA-N
Molecular Weight 186.210 g/mol
SMILES Oc1c(C#CC(=C)C)cc(C=O)cc1
SPLASH splash10-000i-0900000000-d95e71956756ef0a35b5
Source of Spectrum H-76-429-1
Wiley ID 1183249