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1-Adamantylthioacetic acid benzylamide
SpectraBase Compound ID 9CZSFGVkZIQ
InChI InChI=1S/C19H25NS/c21-18(20-13-14-4-2-1-3-5-14)12-19-9-15-6-16(10-19)8-17(7-15)11-19/h1-5,15-17H,6-13H2,(H,20,21)/t15-,16+,17-,19-
InChIKey UIPHXUCRQVHTCY-SXOLKLDHSA-N
Mol Weight 299.48 g/mol
Molecular Formula C19H25NS
Exact Mass 299.170771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jjgq9Cp5uiX
Name 1-Adamantylthioacetic acid benzylamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NS
InChI InChI=1S/C19H25NS/c21-18(20-13-14-4-2-1-3-5-14)12-19-9-15-6-16(10-19)8-17(7-15)11-19/h1-5,15-17H,6-13H2,(H,20,21)/t15-,16+,17-,19-
InChIKey UIPHXUCRQVHTCY-SXOLKLDHSA-N
Molecular Weight 299.476 g/mol
SMILES N(C(CC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=S)Cc1ccccc1
SPLASH splash10-0006-9000000000-1d29ea991c05ca907255
Source of Spectrum O1-47-1212-5i
Synonyms 2-(1-adamantyl)-N-benzylethanethioamide 2-(1-adamantyl)-N-(phenylmethyl)ethanethioamide
Wiley ID 1690375