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4-Hydroxy-3,4-dihydro-1H-benzo[7]annulen-5(2H)-one
SpectraBase Compound ID GOEu0SfDTTB
InChI InChI=1S/C11H12O2/c12-9-6-2-1-4-8-5-3-7-10(13)11(8)9/h1-2,4,6,10,13H,3,5,7H2
InChIKey VVFINOKPTSUCSP-UHFFFAOYSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42iPME7SeIx
Name 4-Hydroxy-3,4-dihydro-1H-benzo[7]annulen-5(2H)-one
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.083729624 u
Formula C11H12O2
InChI InChI=1S/C11H12O2/c12-9-6-2-1-4-8-5-3-7-10(13)11(8)9/h1-2,4,6,10,13H,3,5,7H2
InChIKey VVFINOKPTSUCSP-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95 or API QSTAR PULSAR iLC/MS/TOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201711439
Molecular Weight 176.215 g/mol
Quality 122
Reported Formula C11H12O2
SMILES OC1CCCC2=C1C(C=CC=C2)=O
SPLASH splash10-004i-0900000000-8df39fe35f2205964857
Source of Spectrum ACI-57-SM65-3T (DOI: 10.1002/anie.201711439)
Thin-Layer Chromatography 0.15 (EtOAc/hexane, 30%)
Wiley ID 1890713