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2-Methyl-5-nitrophenyl pivalate
SpectraBase Compound ID 2kNdy50a14D
InChI InChI=1S/C12H15NO4/c1-8-5-6-9(13(15)16)7-10(8)17-11(14)12(2,3)4/h5-7H,1-4H3
InChIKey LALHQWWTXVRMJU-UHFFFAOYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpnlEZhfu6E
Name 2-Methyl-5-nitrophenyl pivalate
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 237.100107963 u
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-8-5-6-9(13(15)16)7-10(8)17-11(14)12(2,3)4/h5-7H,1-4H3
InChIKey LALHQWWTXVRMJU-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200456
Molecular Weight 237.255 g/mol
Quality 126
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])OC(=O)C(C)(C)C
SPLASH splash10-0a4i-9000000000-3250f09721b368338dfb
Source of Spectrum K1-2022-7-16 (DOI: 10.1002/ejoc.202200456)
Wiley ID 1898641