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(E)-4-Ethylhex-2-enal
SpectraBase Compound ID ARHCVjsGeCI
InChI InChI=1S/C8H14O/c1-3-8(4-2)6-5-7-9/h5-8H,3-4H2,1-2H3/b6-5+
InChIKey BAYHQPAXPMJOSU-AATRIKPKSA-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 LCoZcwoUt2e
Name (E)-4-Ethylhex-2-enal
Alternate Name(s) (E)-4-ethyl-2-hexenal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O
InChI InChI=1S/C8H14O/c1-3-8(4-2)6-5-7-9/h5-8H,3-4H2,1-2H3/b6-5+
InChIKey BAYHQPAXPMJOSU-AATRIKPKSA-N
Literature Reference DOI 10.1021/ol102559f
Molecular Weight 126.199 g/mol
SMILES C(CC)(CC)\C=C\C=O
SPLASH splash10-052b-9000000000-b3fe77b914dd4fb3c0e5
Source of Spectrum A1-13-70/SMS21-2c
Wiley ID 1749785