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NIRANIN;(S-METHYLTHIOCARBONIC-ACID-N-METHYL-N-PHENETHYLAMIDE)
SpectraBase Compound ID BYF5AcWFi3g
InChI InChI=1S/C11H15NOS/c1-12(11(13)14-2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKey SFUIBAHKLMJTHH-UHFFFAOYSA-N
Mol Weight 209.31 g/mol
Molecular Formula C11H15NOS
Exact Mass 209.087435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGDfz5mXA6B
Name Niranin
CAS Registry Number 92886-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NOS
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C11H15NOS/c1-12(11(13)14-2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKey SFUIBAHKLMJTHH-UHFFFAOYSA-N
Molecular Weight 209.307 g/mol
SMILES c1cc(ccc1)CCN(C(SC)=O)C
SPLASH splash10-014l-9600000000-9d5acb717a2d1efec5f1
Source ex IAN SOUTHWELL
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886777