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Benzo[b]cyclohepta[d]pyran-11a(11H)-carboxylic acid, 7-methyl-, methyl ester
SpectraBase Compound ID 70AHB4FCCZH
InChI InChI=1S/C17H16O3/c1-12-7-5-6-10-17(16(18)19-2)13-8-3-4-9-15(13)20-11-14(12)17/h3-9,11H,10H2,1-2H3
InChIKey FSHRDFXPMSHMCZ-UHFFFAOYSA-N
Mol Weight 268.31 g/mol
Molecular Formula C17H16O3
Exact Mass 268.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBqKw0ENv7U
Name Benzo[b]cyclohepta[d]pyran-11a(11H)-carboxylic acid, 7-methyl-, methyl ester
Alternate Name(s) 11a-methoxycarbonyl-7-methyl-11,11a-dihydro-cyclohepta(c)-1-benzopyran Methyl 7-methylcyclohepta[c]chromene-11a(11H)-carboxylate
CAS Registry Number 62528-68-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O3
InChI InChI=1S/C17H16O3/c1-12-7-5-6-10-17(16(18)19-2)13-8-3-4-9-15(13)20-11-14(12)17/h3-9,11H,10H2,1-2H3
InChIKey FSHRDFXPMSHMCZ-UHFFFAOYSA-N
Molecular Weight 268.312 g/mol
SMILES C12(C(=COc3c2cccc3)C(=CC=CC1)C)C(=O)OC
SPLASH splash10-0a4i-0390000000-9f74a62f545d34e303f7
Source of Spectrum H-59-1793-23
Wiley ID 1272472