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3-Nitro-5-tosylpentanol

View entire compound with spectra: 1 MS (GC)

3-Nitro-5-tosylpentanol
SpectraBase Compound ID 5Cq9GuRf6qO
InChI InChI=1S/C12H17NO5S/c1-10-2-4-12(5-3-10)19(17,18)9-7-11(6-8-14)13(15)16/h2-5,11,14H,6-9H2,1H3
InChIKey QLXCFWSTMGFZAT-UHFFFAOYSA-N
Mol Weight 287.33 g/mol
Molecular Formula C12H17NO5S
Exact Mass 287.082744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4g4SNvVvbPu
Name 3-Nitro-5-tosylpentanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO5S
InChI InChI=1S/C12H17NO5S/c1-10-2-4-12(5-3-10)19(17,18)9-7-11(6-8-14)13(15)16/h2-5,11,14H,6-9H2,1H3
InChIKey QLXCFWSTMGFZAT-UHFFFAOYSA-N
Molecular Weight 287.330 g/mol
SMILES OCCC(CCS(=O)(=O)c1ccc(C)cc1)N(=O)=O
SPLASH splash10-000l-9400000000-d1b8f0d9ee7c9d80789c
Source of Spectrum AJ-67-3091-11
Synonyms 5-[(4-methylphenyl)sulfonyl]-3-nitro-1-pentanol
Wiley ID 772850