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1H-Indole, 1-(3-nitropropyl)-
SpectraBase Compound ID BjkxxsvxTSr
InChI InChI=1S/C11H12N2O2/c14-13(15)8-3-7-12-9-6-10-4-1-2-5-11(10)12/h1-2,4-6,9H,3,7-8H2
InChIKey XGMKDWZKSZZHJZ-UHFFFAOYSA-N
Mol Weight 204.23 g/mol
Molecular Formula C11H12N2O2
Exact Mass 204.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EiUARE6hhIu
Name 1H-Indole, 1-(3-nitropropyl)-
CAS Registry Number 131322-48-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O2
InChI InChI=1S/C11H12N2O2/c14-13(15)8-3-7-12-9-6-10-4-1-2-5-11(10)12/h1-2,4-6,9H,3,7-8H2
InChIKey XGMKDWZKSZZHJZ-UHFFFAOYSA-N
Molecular Weight 204.229 g/mol
SMILES c1ccc2c(c1)cc[n]2CCCN(=O)=O
SPLASH splash10-0f79-0960000000-b66c4a4261fc8065fc72
Source of Spectrum J-56-899-5
Synonyms 1-(3-Nitropropyl)-1H-indole 1-(3-Nitropropyl)indole
Wiley ID 1201678