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1-(1-Hydroxycyclohexyl)-2-phenoxyethan-1-one
SpectraBase Compound ID 70W4TdM1TL0
InChI InChI=1S/C14H18O3/c15-13(14(16)9-5-2-6-10-14)11-17-12-7-3-1-4-8-12/h1,3-4,7-8,16H,2,5-6,9-11H2
InChIKey RKASKNNNSXSBJV-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID scJs4fuzuW
Name 1-(1-Hydroxycyclohexyl)-2-phenoxyethan-1-one
Appearance Colorless crystals
Carrier Gas Helium (0.7 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.125594437 u
Formula C14H18O3
GC Column (60 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C14H18O3/c15-13(14(16)9-5-2-6-10-14)11-17-12-7-3-1-4-8-12/h1,3-4,7-8,16H,2,5-6,9-11H2
InChIKey RKASKNNNSXSBJV-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP5050A
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.18.44
Molecular Weight 234.295 g/mol
Quality 480
SMILES OC1(C(=O)COC2=CC=CC=C2)CCCCC1
SPLASH splash10-052f-9200000000-c96d9a7e37a111ce226b
Source of Spectrum BJO-18-SM6-4j (DOI: 10.3762/bjoc.18.44)
Wiley ID 1901281