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(R)-(-)-Mellein
SpectraBase Compound ID 1bhJ7Ua4IFf
InChI InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3
InChIKey KWILGNNWGSNMPA-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5n4dYPWDFOE
Name 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-methyl-
CAS Registry Number 17397-85-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3
InChIKey KWILGNNWGSNMPA-UHFFFAOYSA-N
Molecular Weight 178.187 g/mol
SMILES Oc1cccc2CC(C)OC(c12)=O
SPLASH splash10-0059-2900000000-022839c2097a15133ebb
Source of Spectrum LQ-1992-3362-0
Synonyms Isocoumarin, 3,4-dihydro-8-hydroxy-3-methyl- 8-Hydroxy-3-methyl-3,4-dihydro-1H-isochromen-1-one 1H-2-Benzopyran-1-one, 3,4-dihydro-8-hydroxy-3-methyl-, (R)- 3,4-Dihydro-8-hydroxy-3-methylisocoumarin 3-Methyl-8-oxidanyl-3,4-dihydroisochromen-1-one 8-Hydroxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one 8-Hydroxy-3-methyl-3,4-dihydroisochromen-1-one 8-Hydroxy-3-methyl-isochroman-1-one Antibiotic ao-2 Antibiotic bv-1 AO-2 BV-1 Mellein Ochracin
Wiley ID 1173950