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Kaur-16-en-19-oic acid, methyl ester

View entire compound with spectra: 9 NMR, and 3 MS (GC)

Kaur-16-en-19-oic acid, methyl ester
SpectraBase Compound ID CmmkUchfY8Q
InChI InChI=1S/C21H32O2/c1-14-12-21-11-8-16-19(2,17(21)7-6-15(14)13-21)9-5-10-20(16,3)18(22)23-4/h15-17H,1,5-13H2,2-4H3
InChIKey DWTRNJFPDXIFSY-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uLzGYW5duu
Name Kaur-16-en-18-oic acid, methyl ester, (4.beta.)-
CAS Registry Number 5524-25-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-14-12-21-11-8-16-19(2,17(21)7-6-15(14)13-21)9-5-10-20(16,3)18(22)23-4/h15-17H,1,5-13H2,2-4H3
InChIKey DWTRNJFPDXIFSY-UHFFFAOYSA-N
Molecular Weight 316.485 g/mol
SMILES CC12CCCC(C2CCC23C1CCC(C3)C(=C)C2)(C)C(=O)OC
SPLASH splash10-00r6-6896000000-d843e6491eabb56fb348
Source of Spectrum X2-51-1083-9
Wiley ID 1602908