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Butanoic acid, 4-methoxy-2-nitro-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester
SpectraBase Compound ID G4yKkyz4ZBd
InChI InChI=1S/C20H31NO6/c1-19(2,3)14-11-13(26-8)12-15(20(4,5)6)17(14)27-18(22)16(21(23)24)9-10-25-7/h11-12,16H,9-10H2,1-8H3
InChIKey BSHUVMFLKHBEDM-UHFFFAOYSA-N
Mol Weight 381.47 g/mol
Molecular Formula C20H31NO6
Exact Mass 381.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PGNfaHca68
Name Butanoic acid, 4-methoxy-2-nitro-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester
CAS Registry Number 113719-09-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO6
InChI InChI=1S/C20H31NO6/c1-19(2,3)14-11-13(26-8)12-15(20(4,5)6)17(14)27-18(22)16(21(23)24)9-10-25-7/h11-12,16H,9-10H2,1-8H3
InChIKey BSHUVMFLKHBEDM-UHFFFAOYSA-N
Molecular Weight 381.469 g/mol
SMILES CC(c1c(c(cc(c1)OC)C(C)(C)C)OC(=O)C(N(=O)=O)CCOC)(C)C
SPLASH splash10-000j-9570000000-a3faf46987b968da4554
Synonyms 2,6-Ditert-butyl-4-methoxyphenyl 4-methoxy-2-nitrobutanoate 4-Methoxy-2-nitro-butyric acid (2,6-ditert-butyl-4-methoxy-phenyl) ester 4-Methoxy-2-nitrobutanoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester (2,6-ditert-butyl-4-methoxyphenyl) 4-methoxy-2-nitrobutanoate
Wiley ID 1485546