4a,8a-(Methaniminomethano)naphthalene-10-acetic acid, 2-bromo-.alpha.-methyl-9,11-dioxo-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester

SpectraBase Compound ID	5YYTxiOrAVo
InChI	InChI=1S/C25H28BrNO4/c1-15(19(28)31-18-13-16-7-11-23(18,4)22(16,2)3)27-20(29)24-9-5-6-10-25(24,21(27)30)14-17(26)8-12-24/h5-6,8-10,12,14-16,18H,7,11,13H2,1-4H3/t15?,16-,18?,23+,24+,25-/m0/s1
InChIKey	YCZVAOIXGOFTRF-XQJRVNHRSA-N Google Search
Mol Weight	486.41 g/mol
Molecular Formula	C25H28BrNO4
Exact Mass	485.120171 g/mol

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SpectraBase Spectrum ID	Bsb9EU5ILTl
Name	4a,8a-(Methaniminomethano)naphthalene-10-acetic acid, 2-bromo-.alpha.-methyl-9,11-dioxo-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester
Alternate Name(s)	1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 2-{3-bromo-11,13-dioxo-12-azatricyclo[4.4.3.0(1,6)]trideca-2,4,7,9-tetraen-12-yl}propanoate exo-bornyl 3'-bromo-11',13'-dioxo-12'-aza[4.4.3]propella-2',4',7',9'-tetraene-12'-(2S)-4-methylpentanoate
CAS Registry Number	78403-52-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H28BrNO4
InChI	InChI=1S/C25H28BrNO4/c1-15(19(28)31-18-13-16-7-11-23(18,4)22(16,2)3)27-20(29)24-9-5-6-10-25(24,21(27)30)14-17(26)8-12-24/h5-6,8-10,12,14-16,18H,7,11,13H2,1-4H3/t15?,16-,18?,23+,24+,25-/m0/s1
InChIKey	YCZVAOIXGOFTRF-XQJRVNHRSA-N
Molecular Weight	486.406 g/mol
SMILES	C1(N(C([C@@]23C=CC(=C[C@@]12C=CC=C3)Br)=O)C(C(OC1[C@@]2(C(C)(C)[C@](C1)(CC2)[H])C)=O)C)=O
SPLASH	splash10-0a4i-0092000000-73a98883c236d9c5c71f
Source of Spectrum	F-37-165-0
Wiley ID	1396266