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3,4-Dihydroxystyrene
SpectraBase Compound ID BEgZqSHzi53
InChI InChI=1S/C8H8O2/c1-2-6-3-4-7(9)8(10)5-6/h2-5,9-10H,1H2
InChIKey FBTSUTGMWBDAAC-UHFFFAOYSA-N
Mol Weight 136.15 g/mol
Molecular Formula C8H8O2
Exact Mass 136.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 191nNKhTl4v
Name Caffeic acid -CO2 @
Classification Biomolecule
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Exact Mass 136.052429496 u
Formula C8H8O2
InChI InChI=1S/C8H8O2/c1-2-6-3-4-7(9)8(10)5-6/h2-5,9-10H,1H2
InChIKey FBTSUTGMWBDAAC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 136.150 g/mol
SMILES c1(c(ccc(C=C)c1)O)O
SPLASH splash10-0w2i-9100000000-23259a66d80ea12df062
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.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms 3,4-Dihydroxycinnamic acid -CO2
Technique GC/MS
Wiley ID MMPW6e_5757