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2-Butenoic acid, 4-[1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3-(1,5-dioxoheptyl)-4-hy droxy-5-methoxy-2-naphthalenyl]-, methyl ester

View entire compound with spectra: 1 MS (GC)

2-Butenoic acid, 4-[1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3-(1,5-dioxoheptyl)-4-hy droxy-5-methoxy-2-naphthalenyl]-, methyl ester
SpectraBase Compound ID 13GqpBdKktq
InChI InChI=1S/C29H40O7Si/c1-9-19(30)13-10-16-22(31)25-20(15-12-18-24(32)35-6)28(36-37(7,8)29(2,3)4)21-14-11-17-23(34-5)26(21)27(25)33/h11-12,14,17-18,33H,9-10,13,15-16H2,1-8H3/b18-12+
InChIKey NNQFKRMOUMMCKP-LDADJPATSA-N
Mol Weight 528.7 g/mol
Molecular Formula C29H40O7Si
Exact Mass 528.25433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0ePAYREFzI
Name 2-Butenoic acid, 4-[1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3-(1,5-dioxoheptyl)-4-hy droxy-5-methoxy-2-naphthalenyl]-, methyl ester
Alternate Name(s) Methyl (2E)-4-[1-{[tert-butyl(dimethyl)silyl]oxy}-4-hydroxy-5-methoxy-3-(5-oxoheptanoyl)-2-naphthyl]-2-butenoate Methyl 4-(1'-t-butyldimethysilyloxy-4'-hydroxy-5'-methoxy-3'-(5''-oxoheptanoyl)-naphth-2'-yl)-2-butenoate Methyl 4-(1'-t-butyldimethysilyloxy-4'-hydroxy-5'-methoxy-3'-(5''-oxoheptanoyl)-naphth-2'-yl)-2-butenoate
CAS Registry Number 89101-85-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H40O7Si
InChI InChI=1S/C29H40O7Si/c1-9-19(30)13-10-16-22(31)25-20(15-12-18-24(32)35-6)28(36-37(7,8)29(2,3)4)21-14-11-17-23(34-5)26(21)27(25)33/h11-12,14,17-18,33H,9-10,13,15-16H2,1-8H3/b18-12+
InChIKey NNQFKRMOUMMCKP-LDADJPATSA-N
Molecular Weight 528.717 g/mol
SMILES Oc1c2c(c(c(c1C(=O)CCCC(=O)CC)C\C=C\C(=O)OC)O[Si](C(C)(C)C)(C)C)cccc2OC
SPLASH splash10-004i-0000190000-7092a62d69e09edc469e
Source of Spectrum F-40-4734-0
Wiley ID 1403077