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4-(1-nitro-2-hydroxycyclohexyl)butanal
SpectraBase Compound ID 3GqL1mhafuE
InChI InChI=1S/C10H17NO4/c12-8-4-3-7-10(11(14)15)6-2-1-5-9(10)13/h8-9,13H,1-7H2
InChIKey WJBZFDMPKDSSJM-UHFFFAOYSA-N
Mol Weight 215.25 g/mol
Molecular Formula C10H17NO4
Exact Mass 215.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3VzYAH5ynQq
Name 4-(1-nitro-2-hydroxycyclohexyl)butanal
CAS Registry Number 109797-12-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO4
InChI InChI=1S/C10H17NO4/c12-8-4-3-7-10(11(14)15)6-2-1-5-9(10)13/h8-9,13H,1-7H2
InChIKey WJBZFDMPKDSSJM-UHFFFAOYSA-N
Molecular Weight 215.249 g/mol
SMILES OC1C(N(=O)=O)(CCCC=O)CCCC1
SPLASH splash10-05mo-9100000000-57d783127bd7911bd4d3
Source of Spectrum H-69-1619-10
Synonyms 4-(2-hydroxy-1-nitrocyclohexyl)butanal
Wiley ID 1214454