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2E,4E,6Z-7-BROMOHEPTA-2,4,6-TRIENAL
SpectraBase Compound ID 4nw7bZaS3IQ
InChI InChI=1S/C7H7BrO/c8-6-4-2-1-3-5-7-9/h1-7H/b2-1+,5-3+,6-4-
InChIKey VZDSNTXGICFLSE-QBUNVUJHSA-N
Mol Weight 187.04 g/mol
Molecular Formula C7H7BrO
Exact Mass 185.968028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IWY0NVXCUu5
Name (2E,4E,6Z)-7-bromanylhepta-2,4,6-trienal
Alternate Name(s) (2E,4E,6Z)-7-bromohepta-2,4,6-trienal
Comments Less than 3 mono-isotopic peaks
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Formula C7H7BrO
InChI InChI=1S/C7H7BrO/c8-6-4-2-1-3-5-7-9/h1-7H/b2-1+,5-3+,6-4-
InChIKey VZDSNTXGICFLSE-QBUNVUJHSA-N
Molecular Weight 187.036 g/mol
SMILES C(\C=C\C=C\C=C/Br)=O
SPLASH splash10-052r-0900000000-84fe0daf27fa6085049e
Source of Spectrum KC-0-1642-2
Wiley ID 822540