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1,2-Dioxin-3-acetic acid, 6-(10-dodecenyl)-3,6-dihydro-6-methoxy-, methyl ester, [3.alpha.,6.alpha.,6(E)]-
SpectraBase Compound ID AtjXiHTTT97
InChI InChI=1S/C20H34O5/c1-4-5-6-7-8-9-10-11-12-13-15-20(23-3)16-14-18(24-25-20)17-19(21)22-2/h4-5,14,16,18H,6-13,15,17H2,1-3H3/b5-4+
InChIKey KSKGQTBFDMXQNE-SNAWJCMRSA-N
Mol Weight 354.5 g/mol
Molecular Formula C20H34O5
Exact Mass 354.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XGgLz6elrv
Name 1,2-Dioxin-3-acetic acid, 6-(10-dodecenyl)-3,6-dihydro-6-methoxy-, methyl ester, [3.alpha.,6.alpha.,6(E)]-
CAS Registry Number 107484-62-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O5
InChI InChI=1S/C20H34O5/c1-4-5-6-7-8-9-10-11-12-13-15-20(23-3)16-14-18(24-25-20)17-19(21)22-2/h4-5,14,16,18H,6-13,15,17H2,1-3H3/b5-4+
InChIKey KSKGQTBFDMXQNE-SNAWJCMRSA-N
Molecular Weight 354.487 g/mol
SMILES COC(=O)CC1OOC(CCCCCCCCC\C=C\C)(OC)C=C1
SPLASH splash10-0a4l-9200000000-b7f6d94b5d01774ee61b
Source of Spectrum F-43-267-6
Synonyms Methyl (6-[(10E)-10-dodecenyl]-6-methoxy-3,6-dihydro-1,2-dioxin-3-yl)acetate 2-[6-[(E)-dodec-10-enyl]-6-methoxy-3H-1,2-dioxin-3-yl]acetic acid methyl ester 2-[6-[(E)-dodec-10-enyl]-6-methoxy-3H-o-dioxin-3-yl]acetic acid methyl ester Methyl 2-[6-[(E)-dodec-10-enyl]-6-methoxy-3H-1,2-dioxin-3-yl]acetate Methyl 2-[6-[(E)-dodec-10-enyl]-6-methoxy-3H-1,2-dioxin-3-yl]ethanoate
Wiley ID 1344638