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(S)-(+)-2-Nitro-1-(4-nitrophenyl)ethanol
SpectraBase Compound ID CuTglPn2MGQ
InChI InChI=1S/C8H8N2O5/c11-8(5-9(12)13)6-1-3-7(4-2-6)10(14)15/h1-4,8,11H,5H2/t8-/m1/s1
InChIKey IBGLUMJSLYZZRX-MRVPVSSYSA-N
Mol Weight 212.16 g/mol
Molecular Formula C8H8N2O5
Exact Mass 212.043321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Mbxm7zeMrS
Name (S)-(+)-2-Nitro-1-(4-nitrophenyl)ethanol
Alternate Name(s) (S)-2-nitro-1-(4-nitrophenyl)ethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8N2O5
InChI InChI=1S/C8H8N2O5/c11-8(5-9(12)13)6-1-3-7(4-2-6)10(14)15/h1-4,8,11H,5H2/t8-/m1/s1
InChIKey IBGLUMJSLYZZRX-MRVPVSSYSA-N
Literature Reference DOI 10.1002/adsc.201200337
Molecular Weight 212.161 g/mol
SMILES O[C@@](c1ccc([N+](=O)[O-])cc1)(C[N+](=O)[O-])[H]
SPLASH splash10-0udi-4900000000-8fd14aed0aceaee7430a
Source of Spectrum ASC-354-n/a/SM20-25
Wiley ID 1762676