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1-(4'-methoxyphenyl)-2-nitro-1-propargyloxyethane
SpectraBase Compound ID 452GBTe4UDa
InChI InChI=1S/C12H13NO4/c1-3-8-17-12(9-13(14)15)10-4-6-11(16-2)7-5-10/h1,4-7,12H,8-9H2,2H3
InChIKey CVHLOHFJINKKSC-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C24sojjNX56
Name 1-(4'-methoxyphenyl)-2-nitro-1-propargyloxyethane
Alternate Name(s) 1-Methoxy-4-[2-nitro-1-(2-propynyloxy)ethyl]benzene
CAS Registry Number 132440-04-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-3-8-17-12(9-13(14)15)10-4-6-11(16-2)7-5-10/h1,4-7,12H,8-9H2,2H3
InChIKey CVHLOHFJINKKSC-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
SMILES C(N(=O)=O)C(c1ccc(cc1)OC)OCC#C
SPLASH splash10-002r-0910000000-51e57ab24820ab76ee80
Source of Spectrum K-124-1184-10
Wiley ID 1237015