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Cyclobenzaprine
SpectraBase Compound ID IMaculKuqg8
InChI InChI=1S/C20H21N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-14H,7,15H2,1-2H3
InChIKey JURKNVYFZMSNLP-UHFFFAOYSA-N
Mol Weight 275.39 g/mol
Molecular Formula C20H21N
Exact Mass 275.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AINiA2cjDVf
Name Cyclobenzaprine
Alternate Name(s) Flexeril 3-(5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine
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Formula C20H21N
InChI InChI=1S/C20H21N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-14H,7,15H2,1-2H3
InChIKey JURKNVYFZMSNLP-UHFFFAOYSA-N
Molecular Weight 275.395 g/mol
SMILES CN(C)CCC=C1c2ccccc2C=Cc2ccccc12
SPLASH splash10-0a4i-9140000000-630ca3e8cec469db0de5
Source of Spectrum SWG-33-1634-0
Wiley ID 1809289