For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(S)-trans 2-(2'-(2-chlorophenyl)cyclopropyl)-4,4-dimethylpentan-3-one
SpectraBase Compound ID 9VWCOkkkdMT
InChI InChI=1S/C16H21ClO/c1-10(15(18)16(2,3)4)12-9-13(12)11-7-5-6-8-14(11)17/h5-8,10,12-13H,9H2,1-4H3/t10-,12-,13-/m0/s1
InChIKey NANSVNKQPXBDMA-DRZSPHRISA-N
Mol Weight 264.8 g/mol
Molecular Formula C16H21ClO
Exact Mass 264.128093 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9nSmPv7EVus
Name (S)-trans 2-(2'-(2-chlorophenyl)cyclopropyl)-4,4-dimethylpentan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21ClO
InChI InChI=1S/C16H21ClO/c1-10(15(18)16(2,3)4)12-9-13(12)11-7-5-6-8-14(11)17/h5-8,10,12-13H,9H2,1-4H3/t10-,12-,13-/m0/s1
InChIKey NANSVNKQPXBDMA-DRZSPHRISA-N
Literature Reference DOI 10.1002/ajoc.201700541
Molecular Weight 264.796 g/mol
SMILES C(C([C@]([C@]1([C@@](C1)(c1c(cccc1)Cl)[H])[H])(C)[H])=O)(C)(C)C
SPLASH splash10-0a4i-9200000000-fff30f692c102c667c5a
Source of Spectrum AJO-6-SM4-3e
Synonyms (S)-4-((1R,2R)-2-(2-chlorophenyl)cyclopropyl)-2,2-dimethylpentan-3-one
Wiley ID 1813044