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4'-nitrospiro[1,3-dioxolane-2,1'-decalin]-4'a-ol
SpectraBase Compound ID LPpzJBmHm5T
InChI InChI=1S/C12H19NO5/c14-11-5-2-1-3-9(11)12(17-7-8-18-12)6-4-10(11)13(15)16/h9-10,14H,1-8H2
InChIKey DSCQCPSTIQKGCE-UHFFFAOYSA-N
Mol Weight 257.29 g/mol
Molecular Formula C12H19NO5
Exact Mass 257.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Ms7UdWJoMB
Name 4'-nitrospiro[1,3-dioxolane-2,1'-decalin]-4'a-ol
Alternate Name(s) 4a-Hydroxy-4-nitrodecalin-1-one ethylene ketal 5-Nitro-4a-spiro[1,2,3,4,5,6,7,8a-octahydronaphthalene-8,2'-1,3-dioxolane]ol 5-Nitrospiro[1,2,3,4,5,6,7,8a-octahydronaphthalene-8,2'-1,3-dioxolane]-4a-ol
CAS Registry Number 79880-72-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO5
InChI InChI=1S/C12H19NO5/c14-11-5-2-1-3-9(11)12(17-7-8-18-12)6-4-10(11)13(15)16/h9-10,14H,1-8H2
InChIKey DSCQCPSTIQKGCE-UHFFFAOYSA-N
Molecular Weight 257.286 g/mol
SMILES OC12CCCCC2C2(CCC1N(=O)=O)OCCO2
SPLASH splash10-000i-9610000000-a41ef9349fe8a1bef774
Wiley ID 1478990