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(E)-3,4,4-trimethyl-2-pentenal
SpectraBase Compound ID 9i6iApfWdEF
InChI InChI=1S/C8H14O/c1-7(5-6-9)8(2,3)4/h5-6H,1-4H3/b7-5+
InChIKey RJURJJIOVZPPRR-FNORWQNLSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69MfXqe1tkh
Name (E)-3,4,4-trimethyl-2-pentenal
CAS Registry Number 65275-95-8
Comments Less than 3 mono-isotopic peaks
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Formula C8H14O
InChI InChI=1S/C8H14O/c1-7(5-6-9)8(2,3)4/h5-6H,1-4H3/b7-5+
InChIKey RJURJJIOVZPPRR-FNORWQNLSA-N
Molecular Weight 126.199 g/mol
SMILES C(\C(=C\C=O)C)(C)(C)C
SPLASH splash10-03fr-0900000000-5bbe73c70ca36c1071e8
Source of Spectrum J-43-1597-0
Synonyms (E)-3,4,4-trimethylpent-2-enal 3,4,4-Trimethyl-2-pentenal
Wiley ID 1130073