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anti-7-Isopropylbicyclo[2.2.1]heptane-2,3-dione-(Z)-monotosyl-hydrazone
SpectraBase Compound ID 1TdHCoZD5Hy
InChI InChI=1S/C17H22N2O3S/c1-10(2)15-13-8-9-14(15)17(20)16(13)18-19-23(21,22)12-6-4-11(3)5-7-12/h4-7,10,13-15,19H,8-9H2,1-3H3/b18-16-/t13-,14+,15?/m1/s1
InChIKey IBDWYQGNHSXONY-RUYDEBNNSA-N
Mol Weight 334.43 g/mol
Molecular Formula C17H22N2O3S
Exact Mass 334.135114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7aoM81vR3BX
Name anti-7-Isopropylbicyclo[2.2.1]heptane-2,3-dione-(Z)-monotosyl-hydrazone
Alternate Name(s) syn-7-Isopropylbicyclo[2.2.1]heptane-2,3-dione-(Z)-monotosyl-hydrazone N'-[(2Z)-7-isopropyl-3-oxobicyclo[2.2.1]hept-2-ylidene]-4-methylbenzenesulfonohydrazide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O3S
InChI InChI=1S/C17H22N2O3S/c1-10(2)15-13-8-9-14(15)17(20)16(13)18-19-23(21,22)12-6-4-11(3)5-7-12/h4-7,10,13-15,19H,8-9H2,1-3H3/b18-16-/t13-,14+,15?/m1/s1
InChIKey IBDWYQGNHSXONY-RUYDEBNNSA-N
Molecular Weight 334.434 g/mol
SMILES N(\N=C/1C([C@@]2(C([C@]1(CC2)[H])C(C)C)[H])=O)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0udi-0900000000-9542ff6de353cebfd298
Source of Spectrum I-62-1764-0
Wiley ID 1330831