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(+,-)-6,7-epoxy-8-hydroxygeranyl benzoate
SpectraBase Compound ID 5J8I7aWzSMH
InChI InChI=1S/C17H22O4/c1-13(8-9-15-17(2,12-18)21-15)10-11-20-16(19)14-6-4-3-5-7-14/h3-7,10,15,18H,8-9,11-12H2,1-2H3/b13-10+
InChIKey CJYXCFMZYNOVCL-JLHYYAGUSA-N
Mol Weight 290.36 g/mol
Molecular Formula C17H22O4
Exact Mass 290.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nkVLe7LDJ5
Name (+,-)-6,7-epoxy-8-hydroxygeranyl benzoate
Alternate Name(s) (2E)-5-[3-(hydroxymethyl)-3-methyl-2-oxiranyl]-3-methyl-2-pentenyl benzoate
CAS Registry Number 116078-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O4
InChI InChI=1S/C17H22O4/c1-13(8-9-15-17(2,12-18)21-15)10-11-20-16(19)14-6-4-3-5-7-14/h3-7,10,15,18H,8-9,11-12H2,1-2H3/b13-10+
InChIKey CJYXCFMZYNOVCL-JLHYYAGUSA-N
Molecular Weight 290.359 g/mol
SMILES OCC1(OC1CC\C(=C\COC(=O)c1ccccc1)C)C
SPLASH splash10-0a4i-0900000000-6b538c8d79395599326d
Source of Spectrum J-53-4935-15
Wiley ID 1293730