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4-Hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 9Ry96PbnTvk
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4,8,11H,5H2,1-3H3
InChIKey RLDREDRZMOWDOA-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dx1wKAppbDH
Name 4-hydroxy-isophorone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
GC Oven Program Oven temp 250 oC, Splitless injector
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4,8,11H,5H2,1-3H3
InChIKey RLDREDRZMOWDOA-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/cssc.202102434
Molecular Weight 154.209 g/mol
SMILES OC1C(=CC(CC1(C)C)=O)C
SPLASH splash10-006t-9100000000-3ee1de3ce2e13494ae95
Source of Spectrum CSC-15-SM24-24-3
Wiley ID 1877520