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(S)-(+)-1-(3,5-Dimethoxyphenyl)-2-nitroethanol
SpectraBase Compound ID 8q202RpARAS
InChI InChI=1S/C10H13NO5/c1-15-8-3-7(4-9(5-8)16-2)10(12)6-11(13)14/h3-5,10,12H,6H2,1-2H3/t10-/m1/s1
InChIKey AFCYCKCJJYWQJY-SNVBAGLBSA-N
Mol Weight 227.22 g/mol
Molecular Formula C10H13NO5
Exact Mass 227.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Iwn0TlECVc
Name (S)-(+)-1-(3,5-Dimethoxyphenyl)-2-nitroethanol
Alternate Name(s) (S)-1-(3,5-dimethoxyphenyl)-2-nitroethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO5
InChI InChI=1S/C10H13NO5/c1-15-8-3-7(4-9(5-8)16-2)10(12)6-11(13)14/h3-5,10,12H,6H2,1-2H3/t10-/m1/s1
InChIKey AFCYCKCJJYWQJY-SNVBAGLBSA-N
Literature Reference DOI 10.1002/adsc.201200337
Molecular Weight 227.216 g/mol
SMILES O[C@@](c1cc(cc(c1)OC)OC)(C[N+](=O)[O-])[H]
SPLASH splash10-004i-3950000000-a62cc44bb0ef746c986f
Source of Spectrum ASC-354-n/a/SM27-51
Wiley ID 1762707