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Benzarone
SpectraBase Compound ID Gxbk1IbwRAn
InChI InChI=1S/C17H14O3/c1-2-14-16(13-5-3-4-6-15(13)20-14)17(19)11-7-9-12(18)10-8-11/h3-10,18H,2H2,1H3
InChIKey RFRXIWQYSOIBDI-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C17H14O3
Exact Mass 266.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2t2LENyDtXJ
Name Benzarone
CAS Registry Number 1477-19-6
Classification Capillary protectant
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 266.094294308 u
Formula C17H14O3
InChI InChI=1S/C17H14O3/c1-2-14-16(13-5-3-4-6-15(13)20-14)17(19)11-7-9-12(18)10-8-11/h3-10,18H,2H2,1H3
InChIKey RFRXIWQYSOIBDI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 266.296 g/mol
SMILES c1(ccc(cc1)O)C(c1c2ccccc2oc1CC)=O
SPLASH splash10-014i-3590000000-a27fabc605e0f7329826
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: UHY
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1978