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

*Links on SpectraBase are not permalinks.
4-Cyclohexylsulfanyl-3-[1,3]dioxolan-2-yl-6-nitro-benzo[d]isoxazole
SpectraBase Compound ID 5oV0yKFxi6n
InChI InChI=1S/C16H18N2O5S/c19-18(20)10-8-12-14(15(17-23-12)16-21-6-7-22-16)13(9-10)24-11-4-2-1-3-5-11/h8-9,11,16H,1-7H2
InChIKey HRJXCBDRQHKEOF-UHFFFAOYSA-N
Mol Weight 350.39 g/mol
Molecular Formula C16H18N2O5S
Exact Mass 350.093643 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 7czyW7udg1F
Name 4-Cyclohexylsulfanyl-3-[1,3]dioxolan-2-yl-6-nitro-benzo[d]isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O5S
InChI InChI=1S/C16H18N2O5S/c19-18(20)10-8-12-14(15(17-23-12)16-21-6-7-22-16)13(9-10)24-11-4-2-1-3-5-11/h8-9,11,16H,1-7H2
InChIKey HRJXCBDRQHKEOF-UHFFFAOYSA-N
Molecular Weight 350.389 g/mol
SMILES c1(c2c(cc(N(=O)=O)cc2SC2CCCCC2)on1)C1OCCO1
SPLASH splash10-0ac4-9010000000-a3c81c6abd63b99eadf2
Synonyms 4-(cyclohexylthio)-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole 4-(cyclohexylthio)-3-(1,3-dioxolan-2-yl)-6-nitro-indoxazene 4-cyclohexylsulfanyl-3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzoxazole Cyclohexyl 3-(1,3-dioxolan-2-yl)-6-nitro-1,2-benzisoxazol-4-yl sulfide
Wiley ID 1462825