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1-Pentanone, 1,2-bis(4-methoxyphenyl)-4-methyl-4-nitro-
SpectraBase Compound ID C3j7hTrOTwI
InChI InChI=1S/C20H23NO5/c1-20(2,21(23)24)13-18(14-5-9-16(25-3)10-6-14)19(22)15-7-11-17(26-4)12-8-15/h5-12,18H,13H2,1-4H3
InChIKey PLLHYYJHWAFHIO-UHFFFAOYSA-N
Mol Weight 357.41 g/mol
Molecular Formula C20H23NO5
Exact Mass 357.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtlR8vOln2F
Name 1-Pentanone, 1,2-bis(4-methoxyphenyl)-4-methyl-4-nitro-
Alternate Name(s) 1,2-bis(4-methoxyphenyl)-4-methyl-4-nitro-1-pentanone 1,2-bis(4-methoxyphenyl)-4-methyl-4-nitropentan-1-one
CAS Registry Number 89703-94-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO5
InChI InChI=1S/C20H23NO5/c1-20(2,21(23)24)13-18(14-5-9-16(25-3)10-6-14)19(22)15-7-11-17(26-4)12-8-15/h5-12,18H,13H2,1-4H3
InChIKey PLLHYYJHWAFHIO-UHFFFAOYSA-N
Molecular Weight 357.406 g/mol
SMILES C(N(=O)=O)(CC(C(c1ccc(cc1)OC)=O)c1ccc(cc1)OC)(C)C
SPLASH splash10-000i-0900000000-e32e7d0e6cadf4ee00c8
Source of Spectrum B-37-102-0
Wiley ID 1346485