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4-(2,6-Ditert-butyl-4-methoxyphenyl) 1,1-dimethyl 4-(acetylamino)-1,1,4-butanetricarboxylate
SpectraBase Compound ID 7ylABecdZXT
InChI InChI=1S/C26H39NO8/c1-15(28)27-20(12-11-17(22(29)33-9)23(30)34-10)24(31)35-21-18(25(2,3)4)13-16(32-8)14-19(21)26(5,6)7/h13-14,17,20H,11-12H2,1-10H3,(H,27,28)
InChIKey QDSUEUCMMBFCPI-UHFFFAOYSA-N
Mol Weight 493.6 g/mol
Molecular Formula C26H39NO8
Exact Mass 493.267567 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COLd5hugRxc
Name 4-(2,6-Ditert-butyl-4-methoxyphenyl) 1,1-dimethyl 4-(acetylamino)-1,1,4-butanetricarboxylate
CAS Registry Number 113719-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H39NO8
InChI InChI=1S/C26H39NO8/c1-15(28)27-20(12-11-17(22(29)33-9)23(30)34-10)24(31)35-21-18(25(2,3)4)13-16(32-8)14-19(21)26(5,6)7/h13-14,17,20H,11-12H2,1-10H3,(H,27,28)
InChIKey QDSUEUCMMBFCPI-UHFFFAOYSA-N
Molecular Weight 493.597 g/mol
SMILES N(C(CCC(C(OC)=O)C(=O)OC)C(=O)Oc1c(cc(cc1C(C)(C)C)OC)C(C)(C)C)C(=O)C
SPLASH splash10-000i-3290000000-39e8c734998f91c3e4df
Synonyms 4-Acetamidobutane-1,1,4-tricarboxylic acid O4-(2,6-ditert-butyl-4-methoxy-phenyl) ester O1,O1-dimethyl ester 4-O-(2,6-ditert-butyl-4-methoxyphenyl) 1-O,1-O-dimethyl 4-acetamidobutane-1,1,4-tricarboxylate O4-(2,6-ditert-butyl-4-methoxy-phenyl) O1,O1-dimethyl 4-acetamidobutane-1,1,4-tricarboxylate
Wiley ID 1485436