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NUHOXYZKRDKQRN-UHFFFAOYSA-N
SpectraBase Compound ID zJ4Dq8GKBu
InChI InChI=1S/C18H18O3/c1-21-18(20)16-11-12-7-5-6-8-13(12)14-9-3-2-4-10-15(14)17(16)19/h4-8,10,19H,2-3,9,11H2,1H3
InChIKey NUHOXYZKRDKQRN-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C18H18O3
Exact Mass 282.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FKPEHSoPlAF
Name Methyl 5,10,11,12-tetrahydro-7-hydroxybenzo[a]heptalene-6-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O3
InChI InChI=1S/C18H18O3/c1-21-18(20)16-11-12-7-5-6-8-13(12)14-9-3-2-4-10-15(14)17(16)19/h4-8,10,19H,2-3,9,11H2,1H3
InChIKey NUHOXYZKRDKQRN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19970800506
Molecular Weight 282.339 g/mol
SMILES OC1=C(Cc2c(C=3CCCC=CC13)cccc2)C(=O)OC
SPLASH splash10-00e9-4590000000-3fcfa115c9e1d9ea6057
Source of Spectrum H-80-1399-17a
Synonyms Methyl 7-hydroxy-5,10,11,12-tetrahydrobenzo[a]heptalene-6-carboxylate
Wiley ID 1785293