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1-(4-hydroxy-3-methoxyphenyl)pent-1-en-3-one
SpectraBase Compound ID CQtcxLtkct8
InChI InChI=1S/C12H14O3/c1-3-10(13)6-4-9-5-7-11(14)12(8-9)15-2/h4-8,14H,3H2,1-2H3
InChIKey BODVWJBSTHFLKI-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0DMb12nWBU
Name 1-(4-hydroxy-3-methoxyphenyl)pent-1-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.094294308 u
Formula C12H14O3
GC Column DB-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 290oC
InChI InChI=1S/C12H14O3/c1-3-10(13)6-4-9-5-7-11(14)12(8-9)15-2/h4-8,14H,3H2,1-2H3
InChIKey BODVWJBSTHFLKI-UHFFFAOYSA-N
Instrument Name Agilent 700D GC/MC Triple Quad
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202300208
Molecular Weight 206.241 g/mol
Quality 433
SMILES OC1=C(C=C(C=C1)C=CC(CC)=O)OC
SPLASH splash10-004i-1920000000-0c3e56bf14b846eddb5a
Source of Spectrum CSC-16-SM11-HMPPEO (DOI: 10.1002/cssc.202300208)
Wiley ID 1910335