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(3S,4S)-6-(tert-Butyl)-4-(nitromethyl)chroman-3-carbaldehyde
SpectraBase Compound ID GVuAJhadW7g
InChI InChI=1S/C15H19NO4/c1-15(2,3)11-4-5-14-12(6-11)13(7-16(18)19)10(8-17)9-20-14/h4-6,8,10,13H,7,9H2,1-3H3/t10-,13+/m1/s1
InChIKey NNROAUFPBHQJBA-MFKMUULPSA-N
Mol Weight 277.32 g/mol
Molecular Formula C15H19NO4
Exact Mass 277.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E4B9Ue0Nk
Name (3S,4S)-6-(tert-Butyl)-4-(nitromethyl)chroman-3-carbaldehyde
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO4
InChI InChI=1S/C15H19NO4/c1-15(2,3)11-4-5-14-12(6-11)13(7-16(18)19)10(8-17)9-20-14/h4-6,8,10,13H,7,9H2,1-3H3/t10-,13+/m1/s1
InChIKey NNROAUFPBHQJBA-MFKMUULPSA-N
Literature Reference DOI 10.1002/adsc.201200472
Molecular Weight 277.320 g/mol
SMILES c1(ccc2c(c1)[C@]([C@@](CO2)(C=O)[H])(C[N+](=O)[O-])[H])C(C)(C)C
SPLASH splash10-08fr-6590000000-1f1e473a55710edee6ea
Source of Spectrum ASC-354-2629/SM3-3c
Wiley ID 1761503