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Methyl 2,4-dimethyl-4-nitropentanoate
SpectraBase Compound ID BY79BLmCf8I
InChI InChI=1S/C8H15NO4/c1-6(7(10)13-4)5-8(2,3)9(11)12/h6H,5H2,1-4H3
InChIKey FIXGUDASGASFSO-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C8H15NO4
Exact Mass 189.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7No3CvspHNV
Name Methyl 2,4-dimethyl-4-nitropentanoate
Alternate Name(s) 2,4-Dimethyl-4-nitro-valeric acid methyl ester 2,4-Dimethyl-4-nitropentanoic acid methyl ester Pentanoic acid, 2,4-dimethyl-4-nitro-, methyl ester
CAS Registry Number 5762-40-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15NO4
InChI InChI=1S/C8H15NO4/c1-6(7(10)13-4)5-8(2,3)9(11)12/h6H,5H2,1-4H3
InChIKey FIXGUDASGASFSO-UHFFFAOYSA-N
Molecular Weight 189.211 g/mol
SMILES CC(CC(C(OC)=O)C)(N(=O)=O)C
SPLASH splash10-0536-9100000000-15929c1830b86586797a
Wiley ID 1488386