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(R)-5-(1-Nitrobut-3-en-2-yl)benzo[d][1,3]dioxole

View entire compound with spectra: 1 MS (GC)

(R)-5-(1-Nitrobut-3-en-2-yl)benzo[d][1,3]dioxole
SpectraBase Compound ID 9usG5JtHUxT
InChI InChI=1S/C11H11NO4/c1-2-8(6-12(13)14)9-3-4-10-11(5-9)16-7-15-10/h2-5,8H,1,6-7H2/t8-/m0/s1
InChIKey SDTKKGOVCDVNQR-QMMMGPOBSA-N
Mol Weight 221.21 g/mol
Molecular Formula C11H11NO4
Exact Mass 221.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JmTeAmN16
Name (R)-5-(1-Nitrobut-3-en-2-yl)benzo[d][1,3]dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO4
InChI InChI=1S/C11H11NO4/c1-2-8(6-12(13)14)9-3-4-10-11(5-9)16-7-15-10/h2-5,8H,1,6-7H2/t8-/m0/s1
InChIKey SDTKKGOVCDVNQR-QMMMGPOBSA-N
Literature Reference DOI 10.1021/jo301506p
Molecular Weight 221.212 g/mol
SMILES c1cc(cc2c1OCO2)[C@](C[N+](=O)[O-])(C=C)[H]
SPLASH splash10-0103-2910000000-5d6bc0417269e68a5597
Source of Spectrum J-77-8983-2h
Synonyms 5-[(2R)-1-nitrobut-3-en-2-yl]-1,3-benzodioxole
Wiley ID 1747044