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3-[2-Bromo-5-hydroxy-4-methoxy-3-methyl-6-(phenylmethyl)phenylmethyl]-4-isopropyloxycarbonyl-1-methyl-2,5-piperazinedione

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3-[2-Bromo-5-hydroxy-4-methoxy-3-methyl-6-(phenylmethyl)phenylmethyl]-4-isopropyloxycarbonyl-1-methyl-2,5-piperazinedione
SpectraBase Compound ID 8mxhwwFr3N0
InChI InChI=1S/C25H29BrN2O6/c1-14(2)34-25(32)28-19(24(31)27(4)13-20(28)29)12-17-18(11-16-9-7-6-8-10-16)22(30)23(33-5)15(3)21(17)26/h6-10,14,19,30H,11-13H2,1-5H3
InChIKey OZVVHVSPWAPUKH-UHFFFAOYSA-N
Mol Weight 533.42 g/mol
Molecular Formula C25H29BrN2O6
Exact Mass 532.1209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHWAsvn7kp7
Name 3-[2-Bromo-5-hydroxy-4-methoxy-3-methyl-6-(phenylmethyl)phenylmethyl]-4-isopropyloxycarbonyl-1-methyl-2,5-piperazinedione
Alternate Name(s) isopropyl 2-(2-benzyl-6-bromo-3-hydroxy-4-methoxy-5-methylbenzyl)-4-methyl-3,6-dioxo-1-piperazinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29BrN2O6
InChI InChI=1S/C25H29BrN2O6/c1-14(2)34-25(32)28-19(24(31)27(4)13-20(28)29)12-17-18(11-16-9-7-6-8-10-16)22(30)23(33-5)15(3)21(17)26/h6-10,14,19,30H,11-13H2,1-5H3
InChIKey OZVVHVSPWAPUKH-UHFFFAOYSA-N
Molecular Weight 533.419 g/mol
SMILES Oc1c(c(c(c(CC2C(N(CC(N2C(=O)OC(C)C)=O)C)=O)c1Cc1ccccc1)Br)C)OC
SPLASH splash10-0udi-0043900000-6af5b8d326a903170658
Source of Spectrum E2-48-1556-27
Wiley ID 1555414