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1-azido-2-butyl-benzene
SpectraBase Compound ID B7ejCIXpX2M
InChI InChI=1S/C10H13N3/c1-2-3-6-9-7-4-5-8-10(9)12-13-11/h4-5,7-8H,2-3,6H2,1H3
InChIKey UEDIMMIPXLFYOO-UHFFFAOYSA-N
Mol Weight 175.23 g/mol
Molecular Formula C10H13N3
Exact Mass 175.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EASiduPL1Vb
Name 1-azido-2-butyl-benzene
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 175.110947431 u
Formula C10H13N3
InChI InChI=1S/C10H13N3/c1-2-3-6-9-7-4-5-8-10(9)12-13-11/h4-5,7-8H,2-3,6H2,1H3
InChIKey UEDIMMIPXLFYOO-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704260
Molecular Weight 175.235 g/mol
Quality 193
Reported Formula C10H13N3
SMILES C1=CC(=C(C=C1)N=[N+]=[N-])CCCC
SPLASH splash10-014i-1900000000-a273170dec5263cc5d9d
Source of Spectrum ACI-56-SM34-21 (DOI: 10.1002/anie.201704260)
Thin-Layer Chromatography 0.87 (petroleum ether/ethyl acetate, 10:1)
Wiley ID 1896293