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3-(3-keto-3-methoxy-propyl)-4-methyl-5-(2-nitroethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
SpectraBase Compound ID BXjSfr8RcIv
InChI InChI=1S/C16H24N2O6/c1-10-11(6-7-13(19)23-5)14(15(20)24-16(2,3)4)17-12(10)8-9-18(21)22/h17H,6-9H2,1-5H3
InChIKey XHPKRXFXEYBDGZ-UHFFFAOYSA-N
Mol Weight 340.38 g/mol
Molecular Formula C16H24N2O6
Exact Mass 340.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Br4hsZj3fZm
Name 3-(3-keto-3-methoxy-propyl)-4-methyl-5-(2-nitroethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester
Alternate Name(s) 3-(3-Methoxy-3-oxopropyl)-4-methyl-5-(2-nitroethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester tert-Butyl 3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-5-(2-nitroethyl)-1H-pyrrole-2-carboxylate tert-Butyl 3-(3-methoxy-3-oxo-propyl)-4-methyl-5-(2-nitroethyl)-1H-pyrrole-2-carboxylate
CAS Registry Number 121103-69-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24N2O6
InChI InChI=1S/C16H24N2O6/c1-10-11(6-7-13(19)23-5)14(15(20)24-16(2,3)4)17-12(10)8-9-18(21)22/h17H,6-9H2,1-5H3
InChIKey XHPKRXFXEYBDGZ-UHFFFAOYSA-N
Molecular Weight 340.376 g/mol
SMILES [nH]1c(c(c(c1C(OC(C)(C)C)=O)CCC(=O)OC)C)CCN(=O)=O
SPLASH splash10-004i-0693000000-5e2228d64c45e90b1dfd
Source of Spectrum AH-121-895-0
Wiley ID 1334945