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1,4,6-Cycloheptatriene-1-carboxylic acid, 3-(9-hydroxy-9H-fluoren-9-yl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

1,4,6-Cycloheptatriene-1-carboxylic acid, 3-(9-hydroxy-9H-fluoren-9-yl)-, methyl ester
SpectraBase Compound ID IEXdkK1Bcsx
InChI InChI=1S/C22H18O3/c1-25-21(23)15-8-2-3-9-16(14-15)22(24)19-12-6-4-10-17(19)18-11-5-7-13-20(18)22/h2-14,16,24H,1H3
InChIKey WPJUQXVRAITFOT-UHFFFAOYSA-N
Mol Weight 330.38 g/mol
Molecular Formula C22H18O3
Exact Mass 330.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nJKZIQoN59
Name 1,4,6-Cycloheptatriene-1-carboxylic acid, 3-(9-hydroxy-9H-fluoren-9-yl)-, methyl ester
CAS Registry Number 91894-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O3
InChI InChI=1S/C22H18O3/c1-25-21(23)15-8-2-3-9-16(14-15)22(24)19-12-6-4-10-17(19)18-11-5-7-13-20(18)22/h2-14,16,24H,1H3
InChIKey WPJUQXVRAITFOT-UHFFFAOYSA-N
Molecular Weight 330.383 g/mol
SMILES OC1(c2c(cccc2)-c2c1cccc2)C1C=C(C(=O)OC)C=CC=C1
SPLASH splash10-001l-3900000000-fc81efb1a26b0ea3dfb5
Source of Spectrum K-117-2402-0
Synonyms Methyl 3-(9-hydroxy-9H-fluoren-9-yl)-1,4,6-cycloheptatriene-1-carboxylate Methyl 7-(9-hydroxy-9-fluorenyl)-1,3,5-cycloheptatriene-2-carboxylate
Wiley ID 1328297