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(1R,3S)-1-Methoxy-3,7-dimethyl-isochroman
SpectraBase Compound ID KB9RlMhKZKN
InChI InChI=1S/C12H16O2/c1-8-4-5-10-7-9(2)14-12(13-3)11(10)6-8/h4-6,9,12H,7H2,1-3H3/t9-,12+/m0/s1
InChIKey PXALOPHZWKMIAE-JOYOIKCWSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYlVWr9y23v
Name (1R,3S)-1-Methoxy-3,7-dimethyl-isochroman
Comments Less than 3 mono-isotopic peaks
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Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-8-4-5-10-7-9(2)14-12(13-3)11(10)6-8/h4-6,9,12H,7H2,1-3H3/t9-,12+/m0/s1
InChIKey PXALOPHZWKMIAE-JOYOIKCWSA-N
Molecular Weight 192.258 g/mol
SMILES [C@]1(c2c(ccc(c2)C)C[C@@](O1)(C)[H])(OC)[H]
SPLASH splash10-03dl-0900000000-65f48e190d81fb1d6974
Source of Spectrum H1-38-1514-6
Synonyms (1R,3S)-1-methoxy-3,7-dimethyl-3,4-dihydro-1H-2-benzopyran (1R,3S)-3,7-dimethyl-3,4-dihydro-1H-2-benzopyran-1-yl methyl ether 1-Methoxy-3,7-dimethyl3,4-dihydrobenzopyran
Wiley ID 756371