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3-Methyl-2-nitro-4-pentenoic acid ethyl ester
SpectraBase Compound ID CK2kLccqQru
InChI InChI=1S/C8H13NO4/c1-4-6(3)7(9(11)12)8(10)13-5-2/h4,6-7H,1,5H2,2-3H3
InChIKey PHAGKUGETXWJBG-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 J84ptWyZgCu
Name ACETIC ACID, 2-(1-BUTEN-3-YL)-2-NITRO-, ETHYL ESTER (DIASTEREOMERES 1)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H13NO4
InChI InChI=1S/C8H13NO4/c1-4-6(3)7(9(11)12)8(10)13-5-2/h4,6-7H,1,5H2,2-3H3
InChIKey PHAGKUGETXWJBG-UHFFFAOYSA-N
Molecular Weight 187.0841
SMILES C(N(=O)=O)(C(C=C)C)C(OCC)=O
SPLASH splash10-004l-9100000000-0500ba063e6de3cd86cd
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany