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2',3'-Dihydroxy-3'-methylbutyl 4-nitrobenzoate
SpectraBase Compound ID 2qyX2KMZZDZ
InChI InChI=1S/C12H15NO6/c1-12(2,16)10(14)7-19-11(15)8-3-5-9(6-4-8)13(17)18/h3-6,10,14,16H,7H2,1-2H3
InChIKey KXJMRRXMAWKLFT-UHFFFAOYSA-N
Mol Weight 269.25 g/mol
Molecular Formula C12H15NO6
Exact Mass 269.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kcXx2anhML
Name 2',3'-Dihydroxy-3'-methylbutyl 4-nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO6
InChI InChI=1S/C12H15NO6/c1-12(2,16)10(14)7-19-11(15)8-3-5-9(6-4-8)13(17)18/h3-6,10,14,16H,7H2,1-2H3
InChIKey KXJMRRXMAWKLFT-UHFFFAOYSA-N
Molecular Weight 269.253 g/mol
SMILES OC(C(COC(c1ccc(N(=O)=O)cc1)=O)O)(C)C
SPLASH splash10-0zfr-3900000000-96de3194df11674751f7
Source of Spectrum H-79-504-9
Synonyms 2,3-Dihydroxy-3-methylbutyl 4-nitrobenzoate
Wiley ID 1273047