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1-(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-ylmethyl)-4-phenyl-1,2,4-triazolidine-3,5-dione
SpectraBase Compound ID FhZpcdssgRY
InChI InChI=1S/C18H21N3O2/c1-18(2)13-9-8-12(15(18)10-13)11-20-17(23)21(16(22)19-20)14-6-4-3-5-7-14/h3-8,13,15H,9-11H2,1-2H3,(H,19,22)/t13-,15-/m0/s1
InChIKey QOQBFHMXHNYIGM-ZFWWWQNUSA-N
Mol Weight 311.38 g/mol
Molecular Formula C18H21N3O2
Exact Mass 311.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxYmM2YxjpX
Name 1-(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-ylmethyl)-4-phenyl-1,2,4-triazolidine-3,5-dione
Alternate Name(s) 1-[(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methyl]-4-phenyl-1,2,4-triazolidine-3,5-dione 1-[(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)methyl]-4-phenyl-urazole
CAS Registry Number 74402-29-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21N3O2
InChI InChI=1S/C18H21N3O2/c1-18(2)13-9-8-12(15(18)10-13)11-20-17(23)21(16(22)19-20)14-6-4-3-5-7-14/h3-8,13,15H,9-11H2,1-2H3,(H,19,22)/t13-,15-/m0/s1
InChIKey QOQBFHMXHNYIGM-ZFWWWQNUSA-N
Molecular Weight 311.385 g/mol
SMILES N1N(C(N(C1=O)c1ccccc1)=O)CC1=CC[C@]2(C[C@@]1(C2(C)C)[H])[H]
SPLASH splash10-0006-9400000000-1b2f5c0e714a1fb687e5
Source of Spectrum W5-1989-34617-30919
Wiley ID 1312526