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1,3-Endo-4-Trimethylbicyclo[2.2.1]heptan-2-yl 4-Nitrobenzoate
SpectraBase Compound ID UAquX2hyaB
InChI InChI=1S/C17H21NO4/c1-11-14(17(3)9-8-16(11,2)10-17)22-15(19)12-4-6-13(7-5-12)18(20)21/h4-7,11,14H,8-10H2,1-3H3/t11-,14+,16+,17-/m0/s1
InChIKey XRUDYTFPZSEHSW-WQFMGJDKSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hrxPCZF042
Name 1,3-Endo-4-Trimethylbicyclo[2.2.1]heptan-2-yl 4-Nitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-11-14(17(3)9-8-16(11,2)10-17)22-15(19)12-4-6-13(7-5-12)18(20)21/h4-7,11,14H,8-10H2,1-3H3/t11-,14+,16+,17-/m0/s1
InChIKey XRUDYTFPZSEHSW-WQFMGJDKSA-N
Literature Reference DOI 10.1021/jo500942a
Molecular Weight 303.358 g/mol
SMILES [C@@]1(C)([H])[C@@]2(C)C[C@](C)(CC2)[C@]1([H])OC(=O)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-0002-9500000000-d86c9dd39ec42d4a76ac
Source of Spectrum J-79-6730-((endo)_15b'')
Synonyms (1S,2R,3R,4R)-1,3,4-trimethylbicyclo[2.2.1]heptan-2-yl 4-nitrobenzoate
Wiley ID 1746302