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4-(6b,7,8,9,10,10a-Hexahydrofluoranthen-(1 and 3)-yl)-butyric acid
SpectraBase Compound ID 7ktoxBIKF4V
InChI InChI=1S/C20H22O2/c21-18(22)10-4-6-14-12-11-13-5-3-9-17-15-7-1-2-8-16(15)19(14)20(13)17/h3,5,9,11-12,15-16H,1-2,4,6-8,10H2,(H,21,22)
InChIKey IHICHFUHXIHKLO-UHFFFAOYSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rl4lVmYLKF
Name 4-(6b,7,8,9,10,10a-Hexahydrofluoranthen-(1 and 3)-yl)-butyric acid
Alternate Name(s) 4-(6b,7,8,9,10,10a-hexahydro-1-fluoranthenyl)butanoic acid
CAS Registry Number 77060-96-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O2
InChI InChI=1S/C20H22O2/c21-18(22)10-4-6-14-12-11-13-5-3-9-17-15-7-1-2-8-16(15)19(14)20(13)17/h3,5,9,11-12,15-16H,1-2,4,6-8,10H2,(H,21,22)
InChIKey IHICHFUHXIHKLO-UHFFFAOYSA-N
Molecular Weight 294.394 g/mol
SMILES OC(CCCc1c2c3c(cccc3cc1)C1C2CCCC1)=O
SPLASH splash10-006x-0090000000-d19f3455dca2a652d405
Source of Spectrum J-46-2576-0
Wiley ID 1297750