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JWH-210 (Cl)

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

JWH-210 (Cl)
SpectraBase Compound ID 1dB4NyDdMIv
InChI InChI=1S/C26H26ClNO/c1-3-4-9-16-28-17-24(22-12-7-8-13-25(22)28)26(29)23-15-14-19(18(2)27)20-10-5-6-11-21(20)23/h5-8,10-15,17-18H,3-4,9,16H2,1-2H3
InChIKey IOFIOOLRCAJETN-UHFFFAOYSA-N
Mol Weight 403.95 g/mol
Molecular Formula C26H26ClNO
Exact Mass 403.170292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IJdAYasvXZZ
Name jwh-210 (cl)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.170292160 u
Formula C26H26ClNO
InChI InChI=1S/C26H26ClNO/c1-3-4-9-16-28-17-24(22-12-7-8-13-25(22)28)26(29)23-15-14-19(18(2)27)20-10-5-6-11-21(20)23/h5-8,10-15,17-18H,3-4,9,16H2,1-2H3
InChIKey IOFIOOLRCAJETN-UHFFFAOYSA-N
Molecular Weight 403.953 g/mol
SMILES C=1(C=2C(N(C1)CCCCC)=CC=CC2)C(C1=C2C(=C(C=C1)C(Cl)C)C=CC=C2)=O