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(1S,2R)-5-(3',5'-Dimethylfur-2'-yl)-2-cyano-2-acetoxy-1,8-dimethyl-7-oxabicyclo[4.3.0]nona-5,8-diene
SpectraBase Compound ID AloVTTyZ3H8
InChI InChI=1S/C19H21NO4/c1-11-8-12(2)22-16(11)15-6-7-19(10-20,24-14(4)21)18(5)9-13(3)23-17(15)18/h8-9H,6-7H2,1-5H3/t18-,19-/m0/s1
InChIKey NHBZALBKWUYKEB-OALUTQOASA-N
Mol Weight 327.38 g/mol
Molecular Formula C19H21NO4
Exact Mass 327.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjyiSYBaR6L
Name (1S,2R)-5-(3',5'-Dimethylfur-2'-yl)-2-cyano-2-acetoxy-1,8-dimethyl-7-oxabicyclo[4.3.0]nona-5,8-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-11-8-12(2)22-16(11)15-6-7-19(10-20,24-14(4)21)18(5)9-13(3)23-17(15)18/h8-9H,6-7H2,1-5H3/t18-,19-/m0/s1
InChIKey NHBZALBKWUYKEB-OALUTQOASA-N
Molecular Weight 327.380 g/mol
SMILES C1=2[C@@]([C@](C#N)(OC(=O)C)CCC2c2c(cc(o2)C)C)(C=C(O1)C)C
SPLASH splash10-0udi-3191000000-dabeb39aea2bd5401af9
Source of Spectrum H1-36-547-15
Synonyms (3aS,4R)-4-cyano-7-(3,5-dimethyl-2-furyl)-2,3a-dimethyl-3a,4,5,6-tetrahydro-1-benzofuran-4-yl acetate 5-(3',5'-Dimethylfur-2'-yl)-2-cyano-2-acetoxy-1,8-dimethyl-7-oxabicyclo[4.3.0]nona-5,8-diene
Wiley ID 755074