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methyl 2-(18O)oxidanyl-2-phenyl-acetate
SpectraBase Compound ID 6lprhUCKgM
InChI InChI=1S/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3/i10+2
InChIKey ITATYELQCJRCCK-HRVHXUPCSA-N
Mol Weight 168.18 g/mol
Molecular Formula C9H10O218O
Exact Mass 168.067239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Awguvhu5Yqb
Name methyl 2-(18O)oxidanyl-2-phenyl-acetate
Comments Original formula: C9H10O2[18O]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O3
InChI InChI=1S/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3/i10+2
InChIKey ITATYELQCJRCCK-HRVHXUPCSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202101336
Molecular Weight 168.176 g/mol
SMILES [18OH]C(c1ccccc1)C(OC)=O
SPLASH splash10-0a6r-7900000000-fb4c1d952be4a6cc5f14
Source of Spectrum ASC-364-SM51-37
Wiley ID 1868620