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(1S,5R)-1-[(1,2-Dihydroisoquinolin-2-yl)carbonyl]-5,8,8-trimethyl-3-oxabicyclo[3.2.1]octan-2-one
SpectraBase Compound ID 6V75gckjDER
InChI InChI=1S/C20H23NO3/c1-18(2)19(3)9-10-20(18,17(23)24-13-19)16(22)21-11-8-14-6-4-5-7-15(14)12-21/h4-8,11H,9-10,12-13H2,1-3H3/t19-,20-/m0/s1
InChIKey RPRZWXSPOJDEOL-PMACEKPBSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9M8pBsUbCPi
Name (1S,5R)-1-[(1,2-Dihydroisoquinolin-2-yl)carbonyl]-5,8,8-trimethyl-3-oxabicyclo[3.2.1]octan-2-one
Alternate Name(s) (1S,5R)-1-(2(1H)-isoquinolinylcarbonyl)-5,8,8-trimethyl-3-oxabicyclo[3.2.1]octan-2-one
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Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c1-18(2)19(3)9-10-20(18,17(23)24-13-19)16(22)21-11-8-14-6-4-5-7-15(14)12-21/h4-8,11H,9-10,12-13H2,1-3H3/t19-,20-/m0/s1
InChIKey RPRZWXSPOJDEOL-PMACEKPBSA-N
Molecular Weight 325.408 g/mol
SMILES [C@]12(C(OC[C@](CC2)(C1(C)C)C)=O)C(=O)N1Cc2c(C=C1)cccc2
SPLASH splash10-001i-0900000000-33f7b51aa8bde7a26fbf
Source of Spectrum O1-61-309-8
Wiley ID 1592367