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7,8-dihydroxycalamenal
SpectraBase Compound ID HNNjGaqpXav
InChI InChI=1S/C15H20O3/c1-8(2)11-5-4-9(3)13-12(11)6-10(7-16)14(17)15(13)18/h6-9,11,17-18H,4-5H2,1-3H3
InChIKey CIWDTZVJYZCMFC-UHFFFAOYSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6bf6OD20hwS
Name 7,8-dihydroxycalamenal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-8(2)11-5-4-9(3)13-12(11)6-10(7-16)14(17)15(13)18/h6-9,11,17-18H,4-5H2,1-3H3
InChIKey CIWDTZVJYZCMFC-UHFFFAOYSA-N
Instrument Name JEOL JMS-700
Ionization Type EI
Molecular Weight 248.322 g/mol
Reported Formula C15H20O3
SMILES Oc1c(c(cc2c1C(CCC2C(C)C)C)C=O)O
SPLASH splash10-0a4i-0390000000-246622b1ec5241182197
Source of Spectrum JP5843623B2
Wiley ID 1853069