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tert-Butyl 2-(2-nitro-2-propenyl)-1H-indole-1-carboxylate
SpectraBase Compound ID DJYhzQhfSkE
InChI InChI=1S/C16H18N2O4/c1-11(18(20)21)9-13-10-12-7-5-6-8-14(12)17(13)15(19)22-16(2,3)4/h5-8,10H,1,9H2,2-4H3
InChIKey RAJADXKZKUSUFN-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C16H18N2O4
Exact Mass 302.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PqcEeiJxFM
Name tert-Butyl 2-(2-nitro-2-propenyl)-1H-indole-1-carboxylate
CAS Registry Number 80255-11-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O4
InChI InChI=1S/C16H18N2O4/c1-11(18(20)21)9-13-10-12-7-5-6-8-14(12)17(13)15(19)22-16(2,3)4/h5-8,10H,1,9H2,2-4H3
InChIKey RAJADXKZKUSUFN-UHFFFAOYSA-N
Molecular Weight 302.330 g/mol
SMILES c12c(cccc2)[n](c(c1)CC(N(=O)=O)=C)C(OC(C)(C)C)=O
SPLASH splash10-0a4i-4920000000-42ffc5cc327e558c377a
Source of Spectrum H-67-276-0
Synonyms 2-(2-Nitroallyl)-indole-1-carboxylic acid, t-butyl ester 2-(2-nitroallyl)indole-1-carboxylic acid tert-butyl ester 2-(2-nitroprop-2-enyl)-1-indolecarboxylic acid tert-butyl ester tert-Butyl 2-(2-nitroallyl)indole-1-carboxylate tert-Butyl 2-(2-nitroprop-2-enyl)indole-1-carboxylate
Wiley ID 1304552