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Acetic acid (4aR,8aR)-2-benzyl-5-methoxy-3,7-dioxo-1,3,4,7,8,8a-hexahydro-2H-isoquinolin-4a-ylmethyl ester
SpectraBase Compound ID KM9SjgS7qfS
InChI InChI=1S/C20H23NO5/c1-14(22)26-13-20-10-19(24)21(11-15-6-4-3-5-7-15)12-16(20)8-17(23)9-18(20)25-2/h3-7,9,16H,8,10-13H2,1-2H3/t16-,20-/m0/s1
InChIKey OGJWYUBNBFDHPC-JXFKEZNVSA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IvdZVGDkMbo
Name Acetic acid (4aR,8aR)-2-benzyl-5-methoxy-3,7-dioxo-1,3,4,7,8,8a-hexahydro-2H-isoquinolin-4a-ylmethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-14(22)26-13-20-10-19(24)21(11-15-6-4-3-5-7-15)12-16(20)8-17(23)9-18(20)25-2/h3-7,9,16H,8,10-13H2,1-2H3/t16-,20-/m0/s1
InChIKey OGJWYUBNBFDHPC-JXFKEZNVSA-N
Molecular Weight 357.406 g/mol
SMILES [C@]12(C(=CC(C[C@]2(CN(C(C1)=O)Cc1ccccc1)[H])=O)OC)COC(=O)C
SPLASH splash10-0006-9201000000-66a0450d3906ee0f33d1
Source of Spectrum J-57-6046-47
Wiley ID 1346505