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2-Pentenal, 2,4,4-trimethyl-
SpectraBase Compound ID 6Ibw61XzSBG
InChI InChI=1S/C8H14O/c1-7(6-9)5-8(2,3)4/h5-6H,1-4H3/b7-5+
InChIKey ANXYYWCILNEABR-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 QCJPmk8B6
Name 2-Pentenal, 2,4,4-trimethyl-
CAS Registry Number 53907-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-7(6-9)5-8(2,3)4/h5-6H,1-4H3/b7-5+
InChIKey ANXYYWCILNEABR-FNORWQNLSA-N
Molecular Weight 126.199 g/mol
SMILES C\C(C=O)=C/C(C)(C)C
SPLASH splash10-0a6u-9100000000-5aeb1fa5cd530d4442e6
Source of Spectrum AA-0-539-1
Synonyms (2E)-2,4,4-Trimethyl-2-pentenal (E)-2,4,4-trimethylpent-2-enal (E)-2,4,4-trimethyl-2-pentenal 2,4,4-Trimethyl-2-pentenal 4,4-Dimethyl-2-pentene-2-al
Wiley ID 4852