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Cyclobenzaprine

View entire compound with spectra: 1 FTIR, and 21 MS (GC)

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 AuIDUThSatT
Name Cyclobenzaprine
Catalog Number 15885
CAS Registry Number 6202-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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 c12c(C(c3c(C=C2)cccc3)=CCCN(C)C)cccc1
SPLASH splash10-0aor-9370000000-245d32fd2103d7d21e74
Source of Spectrum CAY-2023-633-0
Wiley ID 1888592