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trans,trans-2,4-Hexadienyl acetate
SpectraBase Compound ID IJrW8e1lXAR
InChI InChI=1S/C8H12O2/c1-3-4-5-6-7-10-8(2)9/h3-6H,7H2,1-2H3/b4-3+,6-5+
InChIKey PXVKYPFROMBALG-VNKDHWASSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EY7dvv4arpn
Name Hexa-2,4-dienyl acetate
CAS Registry Number 1516-17-2
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 140.083729624 u
Formula C8H12O2
InChI InChI=1S/C8H12O2/c1-3-4-5-6-7-10-8(2)9/h3-6H,7H2,1-2H3/b4-3+,6-5+
InChIKey PXVKYPFROMBALG-VNKDHWASSA-N
Molecular Weight 140.182 g/mol
Number of Peaks 50
RI1 1067
RI2 740
SMILES C(\C=C\C=C\C)OC(C)=O
SPLASH splash10-0006-9000000000-98d6e80d69a446405a90
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 2,4-Hexadien-1-ol, acetate
Wiley ID LM_FFNSC3_1387