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(3aR,7aS)-4-(4-azidobutyl)-2,2-dimethyl-3a,7a-dihydrobenzo[d][1,3]dioxole
SpectraBase Compound ID FMNBeNk5WZL
InChI InChI=1S/C13H19N3O2/c1-13(2)17-11-8-5-7-10(12(11)18-13)6-3-4-9-15-16-14/h5,7-8,11-12H,3-4,6,9H2,1-2H3/t11-,12+/m0/s1
InChIKey UDDJAAXCPOPLHE-NWDGAFQWSA-N
Mol Weight 249.31 g/mol
Molecular Formula C13H19N3O2
Exact Mass 249.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5elP9v1MDR
Name (3aR,7aS)-4-(4-azidobutyl)-2,2-dimethyl-3a,7a-dihydrobenzo[d][1,3]dioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19N3O2
InChI InChI=1S/C13H19N3O2/c1-13(2)17-11-8-5-7-10(12(11)18-13)6-3-4-9-15-16-14/h5,7-8,11-12H,3-4,6,9H2,1-2H3/t11-,12+/m0/s1
InChIKey UDDJAAXCPOPLHE-NWDGAFQWSA-N
Literature Reference DOI 10.1021/jo400952u
Molecular Weight 249.314 g/mol
SMILES C1(=CC=C[C@@]2(OC(O[C@]12[H])(C)C)[H])CCCCN=[N+]=[N-]
SPLASH splash10-059x-9700000000-530e48968c73ef524266
Source of Spectrum J-78-7110-39
Wiley ID 1745623