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(S)-(+)-1-(2-Methylphenyl)-2-nitroethanol
SpectraBase Compound ID 9nQ1viDT0Xx
InChI InChI=1S/C9H11NO3/c1-7-4-2-3-5-8(7)9(11)6-10(12)13/h2-5,9,11H,6H2,1H3/t9-/m1/s1
InChIKey KMWCGONJLOMMSR-SECBINFHSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mpMOeR1tSs
Name (S)-(+)-1-(2-Methylphenyl)-2-nitroethanol
Alternate Name(s) (S)-2-nitro-1-(o-tolyl)ethanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c1-7-4-2-3-5-8(7)9(11)6-10(12)13/h2-5,9,11H,6H2,1H3/t9-/m1/s1
InChIKey KMWCGONJLOMMSR-SECBINFHSA-N
Literature Reference DOI 10.1002/adsc.201200337
Molecular Weight 181.191 g/mol
SMILES O[C@](C[N+](=O)[O-])(c1c(cccc1)C)[H]
SPLASH splash10-014l-8900000000-d49e0ea5be34a093d0d4
Source of Spectrum ASC-354-n/a/SM21-30
Wiley ID 1762684