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Bicyclo[3.3.1]nonan-9-one, 1,2,4-trimethyl-3-nitro-, (2-endo,3-exo,4-exo)-(.+-.)-
SpectraBase Compound ID 2ybnhzC9ebe
InChI InChI=1S/C12H19NO3/c1-7-9-5-4-6-12(3,11(9)14)8(2)10(7)13(15)16/h7-10H,4-6H2,1-3H3/t7-,8?,9-,10?,12-/m1/s1
InChIKey YAQCJOZXWLXCHO-UHFFFAOYSA-N
Mol Weight 225.29 g/mol
Molecular Formula C12H19NO3
Exact Mass 225.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSgdX3PBGme
Name Bicyclo[3.3.1]nonan-9-one, 1,2,4-trimethyl-3-nitro-, (2-endo,3-exo,4-exo)-(.+-.)-
CAS Registry Number 129967-65-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO3
InChI InChI=1S/C12H19NO3/c1-7-9-5-4-6-12(3,11(9)14)8(2)10(7)13(15)16/h7-10H,4-6H2,1-3H3/t7-,8?,9-,10?,12-/m1/s1
InChIKey YAQCJOZXWLXCHO-UHFFFAOYSA-N
Molecular Weight 225.288 g/mol
SMILES CC1[C@]2(CCC[C@@](C2=O)([C@](C1N(=O)=O)(C)[H])[H])C
SPLASH splash10-067m-9100000000-01e77cbed9c1b27d2a46
Synonyms 1,2,4-Trimethyl-3-nitrobicyclo[3.3.1]nonan-9-one 2,4,5-trimethyl-3-nitro-9-bicyclo[3.3.1]nonanone 2,4,5-trimethyl-3-nitro-bicyclo[3.3.1]nonan-9-one
Wiley ID 1486880