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(-)-Methyl 3,13(16),14-cis-clerdatrien-18-oate

View entire compound with spectra: 1 MS (GC)

(-)-Methyl 3,13(16),14-cis-clerdatrien-18-oate
SpectraBase Compound ID Ajj0dZOxRAq
InChI InChI=1S/C21H32O2/c1-7-15(2)11-13-20(4)16(3)12-14-21(5)17(19(22)23-6)9-8-10-18(20)21/h7,9,16,18H,1-2,8,10-14H2,3-6H3/t16-,18-,20+,21-/m1/s1
InChIKey SIGVIJRINAMQSS-FRTACKCFSA-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 3U5k5hx7Zo
Name (-)-Methyl 3,13(16),14-cis-clerdatrien-18-oate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-7-15(2)11-13-20(4)16(3)12-14-21(5)17(19(22)23-6)9-8-10-18(20)21/h7,9,16,18H,1-2,8,10-14H2,3-6H3/t16-,18-,20+,21-/m1/s1
InChIKey SIGVIJRINAMQSS-FRTACKCFSA-N
Molecular Weight 316.485 g/mol
SMILES [C@]12(C(C(=O)OC)=CCC[C@@]1([C@](CCC(C=C)=C)(C)[C@@](CC2)(C)[H])[H])C
SPLASH splash10-0006-9720000000-4ed0a9e378a32cde48d8
Source of Spectrum QA-39-266-9
Wiley ID 861387