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Benzoic acid, 4-(6-butoxy-5,6,7,8-tetrahydro-2-naphthalenyl)-
SpectraBase Compound ID 78AtHQPbh2G
InChI InChI=1S/C21H24O3/c1-2-3-12-24-20-11-10-18-13-17(8-9-19(18)14-20)15-4-6-16(7-5-15)21(22)23/h4-9,13,20H,2-3,10-12,14H2,1H3,(H,22,23)
InChIKey NXMCNABSHHUZDH-UHFFFAOYSA-N
Mol Weight 324.42 g/mol
Molecular Formula C21H24O3
Exact Mass 324.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVgd8LSdaSp
Name Benzoic acid, 4-(6-butoxy-5,6,7,8-tetrahydro-2-naphthalenyl)-
CAS Registry Number 83787-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O3
InChI InChI=1S/C21H24O3/c1-2-3-12-24-20-11-10-18-13-17(8-9-19(18)14-20)15-4-6-16(7-5-15)21(22)23/h4-9,13,20H,2-3,10-12,14H2,1H3,(H,22,23)
InChIKey NXMCNABSHHUZDH-UHFFFAOYSA-N
Molecular Weight 324.420 g/mol
SMILES OC(c1ccc(-c2cc3CCC(Cc3cc2)OCCCC)cc1)=O
SPLASH splash10-0uk9-0091000000-45cf24284f465a582e6f
Source of Spectrum H-65-1327-0
Synonyms 4-(6-butoxy-5,6,7,8-tetrahydro-2-naphthalenyl)benzoic acid Butyl 4-(6-butoxy-5,6,7,8-tetrahydro-2-naphthyl)benzoic acid
Wiley ID 1323596