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Benzeneacetic acid, .alpha.-(acetylamino)-3,5-bis[4-(hydroxymethyl)phenoxy]-4-methoxy-, methyl ester
SpectraBase Compound ID oBZLmdldPN
InChI InChI=1S/C26H27NO8/c1-16(30)27-24(26(31)33-3)19-12-22(34-20-8-4-17(14-28)5-9-20)25(32-2)23(13-19)35-21-10-6-18(15-29)7-11-21/h4-13,24,28-29H,14-15H2,1-3H3,(H,27,30)
InChIKey KRKGAJXCRGVVJC-UHFFFAOYSA-N
Mol Weight 481.5 g/mol
Molecular Formula C26H27NO8
Exact Mass 481.173667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bhutc6A5RzJ
Name Benzeneacetic acid, .alpha.-(acetylamino)-3,5-bis[4-(hydroxymethyl)phenoxy]-4-methoxy-, methyl ester
CAS Registry Number 69660-42-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO8
InChI InChI=1S/C26H27NO8/c1-16(30)27-24(26(31)33-3)19-12-22(34-20-8-4-17(14-28)5-9-20)25(32-2)23(13-19)35-21-10-6-18(15-29)7-11-21/h4-13,24,28-29H,14-15H2,1-3H3,(H,27,30)
InChIKey KRKGAJXCRGVVJC-UHFFFAOYSA-N
Molecular Weight 481.501 g/mol
SMILES OCc1ccc(Oc2c(c(Oc3ccc(CO)cc3)cc(c2)C(C(=O)OC)NC(=O)C)OC)cc1
SPLASH splash10-022i-0000900000-06b8a5dda1e1e9da5029
Source of Spectrum C-101-444-0
Synonyms Methyl (acetylamino){3,5-bis[4-(hydroxymethyl)phenoxy]-4-methoxyphenyl}acetate N-acetyl methyl 3,5-bis(.beta.-hydroxy methyl phenoxy)-4-methoxy phenylglycino
Wiley ID 1395396