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2'-O-Methylisohyperlatolic Acid

View entire compound with spectra: 1 MS (GC)

2'-O-Methylisohyperlatolic Acid
SpectraBase Compound ID AiDUAtoHMtA
InChI InChI=1S/C28H38O7/c1-5-7-9-10-12-14-19-15-21(33-3)17-23(29)25(19)28(32)35-22-16-20(13-11-8-6-2)26(27(30)31)24(18-22)34-4/h15-18,29H,5-14H2,1-4H3,(H,30,31)
InChIKey LKOJKGNNZIVUPS-UHFFFAOYSA-N
Mol Weight 486.6 g/mol
Molecular Formula C28H38O7
Exact Mass 486.261754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSp6tlgRRFV
Name 2'-O-Methylisohyperlatolic Acid
Alternate Name(s) 4-(2'-Heptyl-4'-methoxy-6'-hydroxybenzoyloxy)-2-methoxy-6-pentylbenzoic acid 4-[(2-heptyl-6-hydroxy-4-methoxybenzoyl)oxy]-2-methoxy-6-pentylbenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38O7
InChI InChI=1S/C28H38O7/c1-5-7-9-10-12-14-19-15-21(33-3)17-23(29)25(19)28(32)35-22-16-20(13-11-8-6-2)26(27(30)31)24(18-22)34-4/h15-18,29H,5-14H2,1-4H3,(H,30,31)
InChIKey LKOJKGNNZIVUPS-UHFFFAOYSA-N
Molecular Weight 486.605 g/mol
SMILES OC(c1c(cc(OC(c2c(cc(cc2CCCCCCC)OC)O)=O)cc1CCCCC)OC)=O
SPLASH splash10-0019-0900000000-f6406b2db6d42327880a
Source of Spectrum B-44-1646-4
Wiley ID 1396517