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1,2-Propanediol, 3-(3-methyl-2-nitrophenoxy)-
SpectraBase Compound ID H36HZ791NHL
InChI InChI=1S/C10H13NO5/c1-7-3-2-4-9(10(7)11(14)15)16-6-8(13)5-12/h2-4,8,12-13H,5-6H2,1H3
InChIKey YNPUANLPDKUGNY-UHFFFAOYSA-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 50G6QaVaVtj
Name 1,2-Propanediol, 3-(3-methyl-2-nitrophenoxy)-
CAS Registry Number 72620-28-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO5
InChI InChI=1S/C10H13NO5/c1-7-3-2-4-9(10(7)11(14)15)16-6-8(13)5-12/h2-4,8,12-13H,5-6H2,1H3
InChIKey YNPUANLPDKUGNY-UHFFFAOYSA-N
Molecular Weight 227.216 g/mol
SMILES OC(CO)COc1c(N(=O)=O)c(ccc1)C
SPLASH splash10-0kp0-9800000000-6e08f3de75a9205d4831
Source of Spectrum W5-1989-7249-1
Synonyms 3-(3-Methyl-2-nitrophenoxy)-1,2-propanediol 3-(3-Methyl-2-nitrophenoxy)propane-1,2-diol
Wiley ID 1228410