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butyl(1,4-dihydroxypent-3-enylidene)oxonium

View entire compound with spectra: 1 MS (GC)

butyl(1,4-dihydroxypent-3-enylidene)oxonium
SpectraBase Compound ID 539n6F11XRY
InChI InChI=1S/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h5H,3-4,6-7H2,1-2H3,(H-,10,11)/p+1
InChIKey XPXOFXHUTFPDKB-UHFFFAOYSA-O
Mol Weight 173.23 g/mol
Molecular Formula C9H17O3
Exact Mass 173.117769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1DZgcsJ2zQ
Name butyl(1,4-dihydroxypent-3-enylidene)oxonium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17O3
InChI InChI=1S/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h5H,3-4,6-7H2,1-2H3,(H-,10,11)/p+1
InChIKey XPXOFXHUTFPDKB-UHFFFAOYSA-O
Ionization Type EI
Literature Reference DOI 10.1002/jccs.202000342
Molecular Weight 173.232 g/mol
SMILES OC(=CCC(=[O+]CCCC)O)C
SPLASH splash10-05fr-0900000000-0ad3af11528fdcea0d9e
Source of Spectrum QA-68-SM3-Fig. S3-2
Wiley ID 1870112