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(1S,2S)-2-azido-1-(benzo[d][1,3]dioxol-5-yl)cyclohexanecarbaldehyde

View entire compound with spectra: 1 MS (GC)

(1S,2S)-2-azido-1-(benzo[d][1,3]dioxol-5-yl)cyclohexanecarbaldehyde
SpectraBase Compound ID AGXtK0vPqu4
InChI InChI=1S/C14H15N3O3/c15-17-16-13-3-1-2-6-14(13,8-18)10-4-5-11-12(7-10)20-9-19-11/h4-5,7-8,13H,1-3,6,9H2/t13-,14-/m0/s1
InChIKey SMCSTLYVLVZNBS-KBPBESRZSA-N
Mol Weight 273.29 g/mol
Molecular Formula C14H15N3O3
Exact Mass 273.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDb762NAsM5
Name (1S,2S)-2-azido-1-(benzo[d][1,3]dioxol-5-yl)cyclohexanecarbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N3O3
InChI InChI=1S/C14H15N3O3/c15-17-16-13-3-1-2-6-14(13,8-18)10-4-5-11-12(7-10)20-9-19-11/h4-5,7-8,13H,1-3,6,9H2/t13-,14-/m0/s1
InChIKey SMCSTLYVLVZNBS-KBPBESRZSA-N
Literature Reference DOI 10.1039/c4cc04707a
Molecular Weight 273.292 g/mol
SMILES C1CC[C@@]([C@@](C1)(C=O)c1cc2c(cc1)OCO2)(N=[N+]=[N-])[H]
SPLASH splash10-05n0-3960000000-ab789d2467a654ff31c1
Source of Spectrum KD-50-10805/SMS16-2h
Wiley ID 1754805