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Penicillic acid
SpectraBase Compound ID FyR1V3yEZ4e
InChI InChI=1S/C8H10O4/c1-5(2)8(11)6(12-3)4-7(9)10/h4H,1H2,2-3H3,(H,9,10)/b6-4-
InChIKey VOUGEZYPVGAPBB-XQRVVYSFSA-N
Mol Weight 170.16 g/mol
Molecular Formula C8H10O4
Exact Mass 170.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LVhH4utGoco
Name 2,5-Hexadienoic acid, 3-methoxy-5-methyl-4-oxo-
CAS Registry Number 90-65-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O4
InChI InChI=1S/C8H10O4/c1-5(2)8(11)6(12-3)4-7(9)10/h4H,1H2,2-3H3,(H,9,10)/b6-4-
InChIKey VOUGEZYPVGAPBB-XQRVVYSFSA-N
Molecular Weight 170.164 g/mol
SMILES OC(\C=C\(C(C(C)=C)=O)OC)=O
SPLASH splash10-004i-9700000000-56b03febbb8d24ae029e
Source of Spectrum MY-1981-0-0
Synonyms (2Z)-3-Methoxy-5-methyl-4-oxo-2,5-hexadienoic acid (2Z)-3-methoxy-5-methyl-4-oxidanylidene-hexa-2,5-dienoic acid (2Z)-3-methoxy-5-methyl-4-oxo-hexa-2,5-dienoic acid (2Z)-4-keto-3-methoxy-5-methyl-hexa-2,5-dienoic acid .gamma.-Keto-.beta.-methoxy-.delta.-methylene-.delta.(sup .alpha.)-hexenoic acid 3-Methoxy-5-methyl-4-oxo-2,5-hexadienoic acid 3-Methoxy-5-methyl-4-oxohexa-2,5-dienoic acid Kyselina penicilova Pencillic acid Penicillic acid BRN 1773464 CCRIS 4941 EINECS 202-008-1 HSDB 3523
Wiley ID 1166306