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1-azido-2-isopropyl-benzene
SpectraBase Compound ID Jgumx8EHkWc
InChI InChI=1S/C9H11N3/c1-7(2)8-5-3-4-6-9(8)11-12-10/h3-7H,1-2H3
InChIKey WZWDRSJNEZGLDX-UHFFFAOYSA-N
Mol Weight 161.21 g/mol
Molecular Formula C9H11N3
Exact Mass 161.095297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9PSbHip1DUp
Name 1-azido-2-isopropyl-benzene
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 161.095297366 u
Formula C9H11N3
InChI InChI=1S/C9H11N3/c1-7(2)8-5-3-4-6-9(8)11-12-10/h3-7H,1-2H3
InChIKey WZWDRSJNEZGLDX-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201704260
Molecular Weight 161.208 g/mol
Quality 342
SMILES C1=CC(=C(C=C1)N=[N+]=[N-])C(C)C
SPLASH splash10-014i-3900000000-166eee40337dc71a633e
Source of Spectrum ACI-56-SM33-15 (DOI: 10.1002/anie.201704260)
Thin-Layer Chromatography 0.88 (petroleum ether/ethyl acetate, 10:1)
Wiley ID 1896289