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Isopavine

View entire compound with spectra: 1 MS (GC)

Isopavine
SpectraBase Compound ID JhTRzoOdaG5
InChI InChI=1S/C20H23NO4/c1-22-17-6-11-5-16-14-9-20(25-4)19(24-3)8-13(14)15(10-21-16)12(11)7-18(17)23-2/h6-9,15-16,21H,5,10H2,1-4H3/t15-,16+/m0/s1
InChIKey ZNIIISXAGSAJQE-UHFFFAOYSA-N
Mol Weight 341.41 g/mol
Molecular Formula C20H23NO4
Exact Mass 341.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AY7aoMCxW2
Name Isopavine
CAS Registry Number 25727-46-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO4
InChI InChI=1S/C20H23NO4/c1-22-17-6-11-5-16-14-9-20(25-4)19(24-3)8-13(14)15(10-21-16)12(11)7-18(17)23-2/h6-9,15-16,21H,5,10H2,1-4H3/t15-,16+/m0/s1
InChIKey ZNIIISXAGSAJQE-UHFFFAOYSA-N
Molecular Weight 341.407 g/mol
SMILES N1[C@@]2(Cc3cc(c(cc3[C@](C1)(c1cc(c(cc21)OC)OC)[H])OC)OC)[H]
SPLASH splash10-01ox-0419000000-a4c74917b2dac3e9fbb1
Source of Spectrum W5-1989-32770-32766
Wiley ID 1335992