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(3R,4R)-6-Chloro-4-(nitromethyl)chroman-3-carbaldehyde
SpectraBase Compound ID EnSxIRwl4Fr
InChI InChI=1S/C11H10ClNO4/c12-8-1-2-11-9(3-8)10(4-13(15)16)7(5-14)6-17-11/h1-3,5,7,10H,4,6H2/t7-,10+/m0/s1
InChIKey ZBELLWRLSFJHDL-OIBJUYFYSA-N
Mol Weight 255.66 g/mol
Molecular Formula C11H10ClNO4
Exact Mass 255.029836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KI7J8Xj1Guy
Name (3R,4R)-6-Chloro-4-(nitromethyl)chroman-3-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10ClNO4
InChI InChI=1S/C11H10ClNO4/c12-8-1-2-11-9(3-8)10(4-13(15)16)7(5-14)6-17-11/h1-3,5,7,10H,4,6H2/t7-,10+/m0/s1
InChIKey ZBELLWRLSFJHDL-OIBJUYFYSA-N
Literature Reference DOI 10.1002/adsc.201200472
Molecular Weight 255.657 g/mol
SMILES c1(ccc2OC[C@@]([C@](c2c1)(C[N+](=O)[O-])[H])(C=O)[H])Cl
SPLASH splash10-016r-3920000000-1564f65d1367041a3c8a
Source of Spectrum ASC-354-2629/SM4-3e
Wiley ID 1761505