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(4-hydroxy-2,4,6-trimethylcyclohexa-2,5-dien-1-one)
SpectraBase Compound ID FAT5L3cOZNn
InChI InChI=1S/C9H12O2/c1-6-4-9(3,11)5-7(2)8(6)10/h4-5,11H,1-3H3
InChIKey ULGPAXANYFUWRP-UHFFFAOYSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoElJTisoWJ
Name (4-hydroxy-2,4,6-trimethylcyclohexa-2,5-dien-1-one)
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 152.083729624 u
Formula C9H12O2
GC Column Agilent HP-5MS (30 m x 320 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C9H12O2/c1-6-4-9(3,11)5-7(2)8(6)10/h4-5,11H,1-3H3
InChIKey ULGPAXANYFUWRP-UHFFFAOYSA-N
Instrument Name Agilent 7890A GC-5975C MSD
Ionization Type EI
Literature Reference DOI 10.1002/chem.201703647
Molecular Weight 152.193 g/mol
Quality 886
SMILES OC1(C=C(C(C(=C1)C)=O)C)C
SPLASH splash10-000i-5900000000-d578fa7f4b317dbf12bf
Source of Spectrum QE-23-SM17-3b (DOI: 10.1002/chem.201703647)
Wiley ID 1909356