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1-{[2'-(Diethyl)(acetyl)methyl]-1'-pyrrolidinylidene}-3-[2"-nitro-1"-(3"',4"',5"'-trimethoxyphenyl)ethyl]pyrrolidin-2-one

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1-{[2'-(Diethyl)(acetyl)methyl]-1'-pyrrolidinylidene}-3-[2"-nitro-1"-(3"',4"',5"'-trimethoxyphenyl)ethyl]pyrrolidin-2-one
SpectraBase Compound ID AjsDbC6zyH
InChI InChI=1S/C26H39N3O7/c1-7-26(8-2,17(3)30)23-10-9-12-27(23)28-13-11-19(25(28)31)20(16-29(32)33)18-14-21(34-4)24(36-6)22(15-18)35-5/h14-15,19-20,23H,7-13,16H2,1-6H3/t19-,20+,23?/m1/s1
InChIKey PULUPFRRXDDRNF-ZCQKWSGTSA-N
Mol Weight 505.6 g/mol
Molecular Formula C26H39N3O7
Exact Mass 505.278801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4fU9z5vt9O
Name 1-{[2'-(Diethyl)(acetyl)methyl]-1'-pyrrolidinylidene}-3-[2"-nitro-1"-(3"',4"',5"'-trimethoxyphenyl)ethyl]pyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H39N3O7
InChI InChI=1S/C26H39N3O7/c1-7-26(8-2,17(3)30)23-10-9-12-27(23)28-13-11-19(25(28)31)20(16-29(32)33)18-14-21(34-4)24(36-6)22(15-18)35-5/h14-15,19-20,23H,7-13,16H2,1-6H3/t19-,20+,23?/m1/s1
InChIKey PULUPFRRXDDRNF-ZCQKWSGTSA-N
Molecular Weight 505.612 g/mol
SMILES C1(N(N2C([C@@]([C@](c3cc(OC)c(c(c3)OC)OC)(C[N+]([O-])=O)[H])(CC2)[H])=O)CCC1)C(C(=O)C)(CC)CC
SPLASH splash10-0006-0109000000-5a1dad9d0e0cd25a19f2
Source of Spectrum K1-2001-4470-3h
Synonyms 1-{[2'-(Diethyl)(acetyl)methyl]-1'-pyrrolidinylidene}-3-[2''-nitro-1''-(3''',4''',5'''-trimethoxyphenyl)ethyl]pyrrolidin-2-one
Wiley ID 813804