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1,5-Naphthalenedicarboxylic acid, 1,2,3,4,4a,7,8,8a-octahydro-6-(3-methoxy-3-oxo-1-propenyl)-1,4a-dimethyl-, 1-methyl ester, [1S-[1.alpha.,4a.alpha.,6(Z),8a.beta.]]-
SpectraBase Compound ID 37xK5IdVOjV
InChI InChI=1S/C19H26O6/c1-18-10-5-11-19(2,17(23)25-4)13(18)8-6-12(15(18)16(21)22)7-9-14(20)24-3/h7,9,13H,5-6,8,10-11H2,1-4H3,(H,21,22)/b9-7+/t13-,18+,19+/m1/s1
InChIKey OBKJPVZHMZSVKY-KZULYQJXSA-N
Mol Weight 350.41 g/mol
Molecular Formula C19H26O6
Exact Mass 350.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8todELRKqCk
Name 1,5-Naphthalenedicarboxylic acid, 1,2,3,4,4a,7,8,8a-octahydro-6-(3-methoxy-3-oxo-1-propenyl)-1,4a-dimethyl-, 1-methyl ester, [1S-[1.alpha.,4a.alpha.,6(Z),8a.beta.]]-
Alternate Name(s) (4aR,5S,8aS)-5-(methoxycarbonyl)-2-[(1E)-3-methoxy-3-oxo-1-propenyl]-5,8a-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-1-naphthalenecarboxylic acid 12,19-Dimethyl hydrogen 11,12-secopodocarpa-8,13-diene-11,12,19-trioate Methyl 1-hydroxycarbonyl-2-[2'-(methoxycarbonyl)ethenyl]-5,9a-dimethyl-3,4,5,6,7,8-hexahydronaphthalene-5-carboxylate
CAS Registry Number 128737-05-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O6
InChI InChI=1S/C19H26O6/c1-18-10-5-11-19(2,17(23)25-4)13(18)8-6-12(15(18)16(21)22)7-9-14(20)24-3/h7,9,13H,5-6,8,10-11H2,1-4H3,(H,21,22)/b9-7+/t13-,18+,19+/m1/s1
InChIKey OBKJPVZHMZSVKY-KZULYQJXSA-N
Molecular Weight 350.411 g/mol
SMILES OC(C=1[C@@]2([C@]([C@](C(=O)OC)(C)CCC2)(CCC1\C=C\C(=O)OC)[H])C)=O
SPLASH splash10-052f-3593000000-cc485b36bdf41b5ec9ea
Source of Spectrum B-43-495-48
Wiley ID 1341933