Debug Info

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KnjZuf4Ms2M
spectrumID
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KnjZuf4Ms2M
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Mass Spectrum (GC)
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(S)-2,3-Dihydro-5-hydroxy-2-(2-methoxyphenyl)-7-methoxy-6,8-dimethyl-4H-1-benzopyran-4-one
SpectraBase Compound ID CMIhvm2Xapd
InChI InChI=1S/C19H20O5/c1-10-17(21)16-13(20)9-15(12-7-5-6-8-14(12)22-3)24-19(16)11(2)18(10)23-4/h5-8,15,21H,9H2,1-4H3/t15-/m0/s1
InChIKey VLNOFBUJRWWGNP-HNNXBMFYSA-N
Mol Weight 328.36 g/mol
Molecular Formula C19H20O5
Exact Mass 328.131074 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnjZuf4Ms2M
Name (S)-2,3-Dihydro-5-hydroxy-2-(2-methoxyphenyl)-7-methoxy-6,8-dimethyl-4H-1-benzopyran-4-one
CAS Registry Number 77744-57-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O5
InChI InChI=1S/C19H20O5/c1-10-17(21)16-13(20)9-15(12-7-5-6-8-14(12)22-3)24-19(16)11(2)18(10)23-4/h5-8,15,21H,9H2,1-4H3/t15-/m0/s1
InChIKey VLNOFBUJRWWGNP-HNNXBMFYSA-N
Molecular Weight 328.364 g/mol
SMILES Oc1c2c(O[C@@](CC2=O)(c2c(OC)cccc2)[H])c(C)c(c1C)OC
SPLASH splash10-004i-0309000000-51062fad0047e39c0e5b
Source of Spectrum J-46-3077-0
Synonyms (2S)-5-hydroxy-7-methoxy-2-(2-methoxyphenyl)-6,8-dimethyl-2,3-dihydro-4H-chromen-4-one
Wiley ID 1326345
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