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2-(3-azidopropyl)-2-isobutylcyclopentane-1,3-dione
SpectraBase Compound ID 2W8KJRqUbeF
InChI InChI=1S/C12H19N3O2/c1-9(2)8-12(6-3-7-14-15-13)10(16)4-5-11(12)17/h9H,3-8H2,1-2H3
InChIKey SULWBEWMBGWGFU-UHFFFAOYSA-N
Mol Weight 237.3 g/mol
Molecular Formula C12H19N3O2
Exact Mass 237.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aR6caY3XCl
Name 2-(3-azidopropyl)-2-isobutylcyclopentane-1,3-dione
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 237.147726862 u
Formula C12H19N3O2
InChI InChI=1S/C12H19N3O2/c1-9(2)8-12(6-3-7-14-15-13)10(16)4-5-11(12)17/h9H,3-8H2,1-2H3
InChIKey SULWBEWMBGWGFU-UHFFFAOYSA-N
Instrument Name Shimadzu GCMSQP2010SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.202107909
Molecular Weight 237.303 g/mol
Quality 156
SMILES C1(C(CCC1=O)=O)(CCCN=[N+]=[N-])CC(C)C
SPLASH splash10-0ab9-9100000000-9a346edb8dd1439ba32e
Source of Spectrum ACI-60-SM44-3m (DOI: 10.1002/anie.202107909)
Wiley ID 1891375