(1S,4S,5S)-4-(1-((Benzoyloxy)methyl)-3-hydroxypropyl)-1-methyl-6-methylenebicyclo[3.3.0]oct-2-ene

SpectraBase Compound ID	6vMVyKo5Q1r
InChI	InChI=1S/C21H26O3/c1-15-8-11-21(2)12-9-18(19(15)21)17(10-13-22)14-24-20(23)16-6-4-3-5-7-16/h3-7,9,12,17-19,22H,1,8,10-11,13-14H2,2H3/t17?,18-,19-,21+/m1/s1
InChIKey	JNCTZUBWBKYNEH-ABYWUZBGSA-N Google Search
Mol Weight	326.44 g/mol
Molecular Formula	C21H26O3
Exact Mass	326.188195 g/mol

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SpectraBase Spectrum ID	5hrnVHNOzuP
Name	(1S,4S,5S)-4-(1-((Benzoyloxy)methyl)-3-hydroxypropyl)-1-methyl-6-methylenebicyclo[3.3.0]oct-2-ene
Alternate Name(s)	2-[(1S,3aS,6aS)-3a-methyl-6-methylene-1,3a,4,5,6,6a-hexahydro-1-pentalenyl]-4-hydroxybutyl benzoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H26O3
InChI	InChI=1S/C21H26O3/c1-15-8-11-21(2)12-9-18(19(15)21)17(10-13-22)14-24-20(23)16-6-4-3-5-7-16/h3-7,9,12,17-19,22H,1,8,10-11,13-14H2,2H3/t17?,18-,19-,21+/m1/s1
InChIKey	JNCTZUBWBKYNEH-ABYWUZBGSA-N
Molecular Weight	326.436 g/mol
SMILES	OCCC(COC(=O)c1ccccc1)[C@]1(C=C[C@]2([C@@]1(C(CC2)=C)[H])C)[H]
SPLASH	splash10-0a4i-0910000000-3db716ed9be761c37ca8
Source of Spectrum	C-118-7115-29
Wiley ID	759901