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7-Methoxy-1,2,3,4,9,10-hexahydrophenanthrene-1-acetic acid

View entire compound with spectra: 1 MS (GC)

7-Methoxy-1,2,3,4,9,10-hexahydrophenanthrene-1-acetic acid
SpectraBase Compound ID 8zLdBo4hnru
InChI InChI=1S/C17H20O3/c1-20-13-6-8-15-12(9-13)5-7-14-11(10-17(18)19)3-2-4-16(14)15/h6,8-9,11H,2-5,7,10H2,1H3,(H,18,19)
InChIKey HHVIKBGVEIONJT-UHFFFAOYSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 725lVld9HJv
Name 7-Methoxy-1,2,3,4,9,10-hexahydrophenanthrene-1-acetic acid
Alternate Name(s) (7-methoxy-1,2,3,4,9,10-hexahydro-1-phenanthrenyl)acetic acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-20-13-6-8-15-12(9-13)5-7-14-11(10-17(18)19)3-2-4-16(14)15/h6,8-9,11H,2-5,7,10H2,1H3,(H,18,19)
InChIKey HHVIKBGVEIONJT-UHFFFAOYSA-N
Molecular Weight 272.344 g/mol
SMILES OC(CC1CCCC=2c3ccc(cc3CCC12)OC)=O
SPLASH splash10-03di-0090000000-2db8a5ce16858f616572
Source of Spectrum Y1-46-4571-17
Wiley ID 1622550