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4-Phenyl-3-cyclobuten-1,2-dione-3d
SpectraBase Compound ID 1ocLd3B58HU
InChI InChI=1S/C10H6O2/c11-9-6-8(10(9)12)7-4-2-1-3-5-7/h1-6H/i6D
InChIKey KLGVPAWHYZDGCX-RAMDWTOOSA-N
Mol Weight 159.16 g/mol
Molecular Formula C10H5DO2
Exact Mass 159.043056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxjuNCRYGV6
Name 4-Phenyl-3-cyclobuten-1,2-dione-3d
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H5DO2
InChI InChI=1S/C10H6O2/c11-9-6-8(10(9)12)7-4-2-1-3-5-7/h1-6H/i6D
InChIKey KLGVPAWHYZDGCX-RAMDWTOOSA-N
Molecular Weight 159.162 g/mol
SMILES C1(=C([D])C(C1=O)=O)c1ccccc1
SPLASH splash10-0udi-0900000000-346de658f6fb118964a9
Source of Spectrum J-61-2093-15
Synonyms 3-deuterio-4-phenylcyclobut-3-ene-1,2-dione 3-deuterio-4-phenyl-cyclobut-3-ene-1,2-dione
Wiley ID 1155659