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3a-[(Methoxy)diphenylmethyl]-5-[1'-(phenylethyl)]-hexahydro-1H-thieno[3,4-c]pyrrole-3a(3H) - 2,2-dioxide
SpectraBase Compound ID DTOjcMO8xmJ
InChI InChI=1S/C28H31NO3S/c1-22(23-12-6-3-7-13-23)29-18-26-19-33(30,31)21-27(26,20-29)28(32-2,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-17,22,26H,18-21H2,1-2H3/t22-,26-,27-/m1/s1
InChIKey UMRGBEHOGIDTPK-GDKKVTFASA-N
Mol Weight 461.62 g/mol
Molecular Formula C28H31NO3S
Exact Mass 461.202465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wFPoVenyzg
Name 3a-[(Methoxy)diphenylmethyl]-5-[1'-(phenylethyl)]-hexahydro-1H-thieno[3,4-c]pyrrole-3a(3H) - 2,2-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31NO3S
InChI InChI=1S/C28H31NO3S/c1-22(23-12-6-3-7-13-23)29-18-26-19-33(30,31)21-27(26,20-29)28(32-2,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-17,22,26H,18-21H2,1-2H3/t22-,26-,27-/m1/s1
InChIKey UMRGBEHOGIDTPK-GDKKVTFASA-N
Molecular Weight 461.620 g/mol
SMILES [C@]12([C@](CN(C2)[C@@](c2ccccc2)(C)[H])(CS(C1)(=O)=O)[H])C(c1ccccc1)(c1ccccc1)OC
SPLASH splash10-0532-0900700000-931a78d0dff817a86519
Source of Spectrum K1-43523-2789-22
Wiley ID 1521243