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3-(2-Hydroxyphenyl)-5-{2-[3-(4-nitrophenyl)]-1,2,3,4-tetrahydronaphthyl}pyrazole
SpectraBase Compound ID A8aOsE6LGBY
InChI InChI=1S/C25H21N3O3/c29-25-8-4-3-7-21(25)23-15-24(27-26-23)22-14-18(13-17-5-1-2-6-20(17)22)16-9-11-19(12-10-16)28(30)31/h1-12,15,18,22,29H,13-14H2,(H,26,27)
InChIKey BPDRZJDLDXGTPN-UHFFFAOYSA-N
Mol Weight 411.46 g/mol
Molecular Formula C25H21N3O3
Exact Mass 411.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rtgFTdeA8e
Name 3-(2-Hydroxyphenyl)-5-{2-[3-(4-nitrophenyl)]-1,2,3,4-tetrahydronaphthyl}pyrazole
Alternate Name(s) 2-{5-[3-(4-nitrophenyl)-1,2,3,4-tetrahydro-1-naphthalenyl]-1H-pyrazol-3-yl}phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21N3O3
InChI InChI=1S/C25H21N3O3/c29-25-8-4-3-7-21(25)23-15-24(27-26-23)22-14-18(13-17-5-1-2-6-20(17)22)16-9-11-19(12-10-16)28(30)31/h1-12,15,18,22,29H,13-14H2,(H,26,27)
InChIKey BPDRZJDLDXGTPN-UHFFFAOYSA-N
Molecular Weight 411.461 g/mol
SMILES Oc1c(-c2n[nH]c(c2)C2c3c(cccc3)CC(C2)c2ccc(N(=O)=O)cc2)cccc1
SPLASH splash10-03di-1531900000-cc87466e76b6ede16e29
Source of Spectrum K1-2004-4354-9
Wiley ID 1561798