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7-Oxabicyclo[2.2.1]heptane-2-carboxamide, N-butyl-3-nitro-, [1R-(2-exo,3-endo)]-
SpectraBase Compound ID 5RLNFuV7eLW
InChI InChI=1S/C11H18N2O4/c1-2-3-6-12-11(14)9-7-4-5-8(17-7)10(9)13(15)16/h7-10H,2-6H2,1H3,(H,12,14)/t7-,8+,9?,10?/m0/s1
InChIKey IWOOSAPNVWJNHO-AFWXGSBKSA-N
Mol Weight 242.27 g/mol
Molecular Formula C11H18N2O4
Exact Mass 242.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7d5F7cHHXWW
Name 7-Oxabicyclo[2.2.1]heptane-2-carboxamide, N-butyl-3-nitro-, [1R-(2-exo,3-endo)]-
CAS Registry Number 108212-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18N2O4
InChI InChI=1S/C11H18N2O4/c1-2-3-6-12-11(14)9-7-4-5-8(17-7)10(9)13(15)16/h7-10H,2-6H2,1H3,(H,12,14)/t7-,8+,9?,10?/m0/s1
InChIKey IWOOSAPNVWJNHO-AFWXGSBKSA-N
Molecular Weight 242.275 g/mol
SMILES N(C(C1C(N(=O)=O)[C@@]2(O[C@]1(CC2)[H])[H])=O)CCCC
SPLASH splash10-0a5l-9210000000-4462b0419e4d4725267c
Source of Spectrum J-52-2329-5
Synonyms N-butyl-3-nitro-7-oxabicyclo[2.2.1]heptane-2-carboxamide n-Butyl-endo-3-nitro-7-oxabicyclo[2.2.1]heptane-exo-2-carboxamide
Wiley ID 1244727