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(2E)-3-(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)prop-2-enoate

View entire compound with spectra: 1 MS (GC)

(2E)-3-(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)prop-2-enoate
SpectraBase Compound ID 9pwyUTt3Mnn
InChI InChI=1S/C12H18N2O2/c1-5-16-12(15)7-6-10-8-11(9(2)3)13-14(10)4/h6-9H,5H2,1-4H3/b7-6+
InChIKey NIXYJGDQFZXOMC-VOTSOKGWSA-N
Mol Weight 222.29 g/mol
Molecular Formula C12H18N2O2
Exact Mass 222.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61evKMOP5jS
Name (2E)-3-(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)prop-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18N2O2
InChI InChI=1S/C12H18N2O2/c1-5-16-12(15)7-6-10-8-11(9(2)3)13-14(10)4/h6-9H,5H2,1-4H3/b7-6+
InChIKey NIXYJGDQFZXOMC-VOTSOKGWSA-N
Molecular Weight 222.288 g/mol
SMILES c1([n](nc(c1)C(C)C)C)\C=C\C(OCC)=O
SPLASH splash10-0a4i-0390000000-6210ed559ef174b3646e
Source of Spectrum F-71-2837-12e
Synonyms Ethyl (E)-3-(3-isopropyl-1-methyl-1H-pyrazol-5-yl)acrylate
Wiley ID 1803018