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2-(3-Methylbenzyl)-1-naphthoic acid

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2-(3-Methylbenzyl)-1-naphthoic acid
SpectraBase Compound ID FirU2GF77Qw
InChI InChI=1S/C19H16O2/c1-13-5-4-6-14(11-13)12-16-10-9-15-7-2-3-8-17(15)18(16)19(20)21/h2-11H,12H2,1H3,(H,20,21)
InChIKey SJLBCQCATFWNKT-UHFFFAOYSA-N
Mol Weight 276.33 g/mol
Molecular Formula C19H16O2
Exact Mass 276.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHSic4VwUUJ
Name 2-(3-Methylbenzyl)-1-naphthoic acid
Alternate Name(s) 2-(m-tolylmethyl)naphthalene-1-carboxylic acid 2-[(3-methylphenyl)methyl]-1-naphthalenecarboxylic acid 2-[(3-methylphenyl)methyl]naphthalene-1-carboxylic acid
CAS Registry Number 69653-22-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O2
InChI InChI=1S/C19H16O2/c1-13-5-4-6-14(11-13)12-16-10-9-15-7-2-3-8-17(15)18(16)19(20)21/h2-11H,12H2,1H3,(H,20,21)
InChIKey SJLBCQCATFWNKT-UHFFFAOYSA-N
Molecular Weight 276.335 g/mol
SMILES OC(=O)c1c2c(ccc1Cc1cc(C)ccc1)cccc2
SPLASH splash10-0a4i-0090000000-7b655ed6070b4c1fb003
Source of Spectrum J-44-1947-0
Wiley ID 1280537