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(E)- and (Z)-15-n-propyl-7,13-labdadiene and (E)- and (Z)-15-n-propyl-8,13-labdadiene
SpectraBase Compound ID EbgZRwukMr2
InChI InChI=1S/C23H40/c1-7-8-9-11-18(2)12-14-20-19(3)13-15-21-22(4,5)16-10-17-23(20,21)6/h11,13,20-21H,7-10,12,14-17H2,1-6H3/b18-11+/t20-,21?,23+/m0/s1
InChIKey DORJEMQURQLGLH-BMVSUBDHSA-N
Mol Weight 316.6 g/mol
Molecular Formula C23H40
Exact Mass 316.313001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8poe6tzk06t
Name (E)- and (Z)-15-n-propyl-7,13-labdadiene and (E)- and (Z)-15-n-propyl-8,13-labdadiene
CAS Registry Number 87953-43-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H40
InChI InChI=1S/C23H40/c1-7-8-9-11-18(2)12-14-20-19(3)13-15-21-22(4,5)16-10-17-23(20,21)6/h11,13,20-21H,7-10,12,14-17H2,1-6H3/b18-11+/t20-,21?,23+/m0/s1
InChIKey DORJEMQURQLGLH-BMVSUBDHSA-N
Molecular Weight 316.573 g/mol
SMILES [C@]12(C(CC=C([C@@]2(CC\C(=C\CCCC)C)[H])C)C(C)(C)CCC1)C
SPLASH splash10-0avj-8910000000-3f525a8ad30636b1a93f
Source of Spectrum J-49-331-0
Synonyms (4aS,5S)-1,1,4a,6-tetramethyl-5-[(3E)-3-methyl-3-octenyl]-1,2,3,4,4a,5,8,8a-octahydronaphthalene
Wiley ID 1317421