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3a,6-Methano-3aH-indene, benzenesulfonic acid deriv.
SpectraBase Compound ID BDPczpd2jym
InChI InChI=1S/C17H22N2O2S/c1-12-4-6-15(7-5-12)22(20,21)19-18-16-11-17-8-2-3-14(17)9-13(16)10-17/h4-7,13-14,19H,2-3,8-11H2,1H3/b18-16-/i11D2
InChIKey XLOICKOYGCAQSO-LXGRFBFQSA-N
Mol Weight 320.45 g/mol
Molecular Formula C17H202D2N2O2S
Exact Mass 320.152753 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62erJBegWKE
Name 3a,6-Methano-3aH-indene, benzenesulfonic acid deriv.
CAS Registry Number 97231-09-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20D2N2O2S
InChI InChI=1S/C17H22N2O2S/c1-12-4-6-15(7-5-12)22(20,21)19-18-16-11-17-8-2-3-14(17)9-13(16)10-17/h4-7,13-14,19H,2-3,8-11H2,1H3/b18-16-/i11D2
InChIKey XLOICKOYGCAQSO-LXGRFBFQSA-N
Molecular Weight 320.447 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)\N=C/1C2CC3(C1([2D])[2D])C(CCC3)C2
SPLASH splash10-06r6-9800000000-cffee64428a584ff3a0f
Source of Spectrum H-68-109-19
Synonyms Benzenesulfonic acid, 4-methyl-, (hexahydro-4-d-3a,6-methano-3aH-inden-5(4H)-ylidene-4-d)hydrazide, (3a.alpha.,6.alpha.,7a.beta.)- 1,2-exo-trimethylnen-[6-endo,6exo-(2)H(2)]-8,9,10-trinorbornan-5-one p-toluenesulfonylhydrazone
Wiley ID 1318424