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3-(1'-Hydroxyethyl)-4,5-dihydroxycyclopent-2-en-1-one

View entire compound with spectra: 1 MS (GC)

3-(1'-Hydroxyethyl)-4,5-dihydroxycyclopent-2-en-1-one
SpectraBase Compound ID AQb8CwgYSsH
InChI InChI=1S/C7H10O4/c1-3(8)4-2-5(9)7(11)6(4)10/h2-3,6-8,10-11H,1H3/t3?,6?,7-/m1/s1
InChIKey JYDDAHDSJLLHSV-CDEHDQBRSA-N
Mol Weight 158.15 g/mol
Molecular Formula C7H10O4
Exact Mass 158.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SaGMSHyls
Name 3-(1'-Hydroxyethyl)-4,5-dihydroxycyclopent-2-en-1-one
Alternate Name(s) Botrytinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O4
InChI InChI=1S/C7H10O4/c1-3(8)4-2-5(9)7(11)6(4)10/h2-3,6-8,10-11H,1H3/t3?,6?,7-/m1/s1
InChIKey JYDDAHDSJLLHSV-CDEHDQBRSA-N
Molecular Weight 158.153 g/mol
SMILES OC1[C@@](C(C=C1C(O)C)=O)(O)[H]
SPLASH splash10-05tg-9700000000-221a9f5e6e7cf1d80fe8
Source of Spectrum G4-70-309-2
Wiley ID 1694871