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2-Phenanthreneacetic acid, 1,2,3,9,10,10a-hexahydro-3-oxo-
SpectraBase Compound ID Gh5F4PVDbZ1
InChI InChI=1S/C16H16O3/c17-15-9-14-11(7-12(15)8-16(18)19)6-5-10-3-1-2-4-13(10)14/h1-4,9,11-12H,5-8H2,(H,18,19)
InChIKey OCMDVMBZPBSTNV-UHFFFAOYSA-N
Mol Weight 256.3 g/mol
Molecular Formula C16H16O3
Exact Mass 256.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJpnXz8vToT
Name 2-Phenanthreneacetic acid, 1,2,3,9,10,10a-hexahydro-3-oxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O3
InChI InChI=1S/C16H16O3/c17-15-9-14-11(7-12(15)8-16(18)19)6-5-10-3-1-2-4-13(10)14/h1-4,9,11-12H,5-8H2,(H,18,19)
InChIKey OCMDVMBZPBSTNV-UHFFFAOYSA-N
Molecular Weight 256.301 g/mol
SMILES OC(=O)CC1CC2CCc3ccccc3C2=CC1=O
SPLASH splash10-00dm-1910000000-d5a5247b05343194a206
Source of Spectrum JX-2015-1-918
Synonyms 2-(3-oxo-1,2,3,9,10,10a-hexahydrophenanthren-2-yl)acetic acid (3-oxo-1,2,3,9,10,10a-hexahydrophenanthren-2-yl)acetic acid 2-(3-oxo-2,9,10,10a-tetrahydro-1H-phenanthren-2-yl)acetic acid 2-(3-oxidanylidene-2,9,10,10a-tetrahydro-1H-phenanthren-2-yl)ethanoic acid
Wiley ID 1721688