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4-Pentenoic acid, 2-methyl-4-nitro-, ethyl ester
SpectraBase Compound ID J3lnI6kGIF9
InChI InChI=1S/C8H13NO4/c1-4-13-8(10)6(2)5-7(3)9(11)12/h6H,3-5H2,1-2H3
InChIKey NCCXPYIVVGFMBN-UHFFFAOYSA-N
Mol Weight 187.19 g/mol
Molecular Formula C8H13NO4
Exact Mass 187.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7oITFPKZVjd
Name 4-Pentenoic acid, 2-methyl-4-nitro-, ethyl ester
CAS Registry Number 78551-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO4
InChI InChI=1S/C8H13NO4/c1-4-13-8(10)6(2)5-7(3)9(11)12/h6H,3-5H2,1-2H3
InChIKey NCCXPYIVVGFMBN-UHFFFAOYSA-N
Molecular Weight 187.195 g/mol
SMILES C=C(N(=O)=O)CC(C)C(=O)OCC
SPLASH splash10-0296-9600000000-c0f6f8ee333120600156
Source of Spectrum H-67-275-0
Synonyms Ethyl 2-methyl-4-nitro-4-pentenoate 2-Methyl-4-nitro-4-pentenoic acid ethyl ester 2-Methyl-4-nitro-pent-4-enoic acid ethyl ester Ethyl 2-methyl-4-nitro-pent-4-enoate
Wiley ID 1183662