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Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-3-(2-nitro-2-propenyl)-, endo-
SpectraBase Compound ID B1XtGOK3f63
InChI InChI=1S/C13H19NO3/c1-8(14(16)17)7-9-10-5-6-13(4,11(9)15)12(10,2)3/h9-10H,1,5-7H2,2-4H3/t9?,10-,13+/m1/s1
InChIKey ISDHUQVHDCKRTE-BGLCMPESSA-N
Mol Weight 237.3 g/mol
Molecular Formula C13H19NO3
Exact Mass 237.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYvGrHWZGzC
Name Bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-3-(2-nitro-2-propenyl)-, endo-
CAS Registry Number 90059-92-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO3
InChI InChI=1S/C13H19NO3/c1-8(14(16)17)7-9-10-5-6-13(4,11(9)15)12(10,2)3/h9-10H,1,5-7H2,2-4H3/t9?,10-,13+/m1/s1
InChIKey ISDHUQVHDCKRTE-BGLCMPESSA-N
Molecular Weight 237.299 g/mol
SMILES [C@]12(C(C(CC(N(=O)=O)=C)[C@](C2(C)C)(CC1)[H])=O)C
SPLASH splash10-0537-9400000000-e3cdf6b9a4d24cf7925c
Source of Spectrum H-67-275-0
Synonyms 1,7,7-trimethyl-3-(2-nitro-2-propenyl)bicyclo[2.2.1]heptan-2-one endo-3-(2'-nitro-2'-propenyl)-2-bornanone
Wiley ID 1239533