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PENTENAL
SpectraBase Compound ID 3HxqSxyhHLP
InChI InChI=1S/C6H10O/c1-6(2)4-3-5-7/h3-6H,1-2H3/b4-3+
InChIKey RIWPMNBTULNXOH-ONEGZZNKSA-N
Mol Weight 98.14 g/mol
Molecular Formula C6H10O
Exact Mass 98.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3etrV588eSt
Name 4-Methylpent-2-enal
Source of Sample Penta Manifacturing
CAS Registry Number 5362-56-1
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 98.073164941 u
Formula C6H10O
InChI InChI=1S/C6H10O/c1-6(2)4-3-5-7/h3-6H,1-2H3/b4-3+
InChIKey RIWPMNBTULNXOH-ONEGZZNKSA-N
Molecular Weight 98.145 g/mol
Number of Peaks 42
RI1 814
RI2 525
RI3 567
RI4 512
SMILES CC(\C=C\C=O)C
SPLASH splash10-052f-9000000000-2db43734a09d963f7969
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Benzeneacetaldehyde, -(3-methylbutylidene)-
Wiley ID LM_FFNSC3_2999