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

*Links on SpectraBase are not permalinks.
1H-Indene, 2,3,3a,4,5,7a-hexahydro-5-methyl-4-nitro-, (3a.alpha.,4.alpha.,5.beta.,7a.alpha.)-(.+-.)-
SpectraBase Compound ID BL1cpHlHoKB
InChI InChI=1S/C10H15NO2/c1-7-5-6-8-3-2-4-9(8)10(7)11(12)13/h5-10H,2-4H2,1H3/t7-,8+,9+,10+/m0/s1
InChIKey BEKCSYWEUMNGNI-SGIHWFKDSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 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 83v98zvQrI1
Name 1H-Indene, 2,3,3a,4,5,7a-hexahydro-5-methyl-4-nitro-, (3a.alpha.,4.alpha.,5.beta.,7a.alpha.)-(.+-.)-
Alternate Name(s) (+/-)-5-Methyl-4-nitro-2,3,3a.alpha.,4.beta.,5.alpha.,7a.alpha.-hexahydro-1H-indene (3aR,4R,5S,7aR)-5-methyl-4-nitro-2,3,3a,4,5,7a-hexahydro-1H-indene
CAS Registry Number 96556-60-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-7-5-6-8-3-2-4-9(8)10(7)11(12)13/h5-10H,2-4H2,1H3/t7-,8+,9+,10+/m0/s1
InChIKey BEKCSYWEUMNGNI-SGIHWFKDSA-N
Molecular Weight 181.235 g/mol
SMILES [C@@]1(N(=O)=O)([C@]2([C@@](CCC2)([H])C=C[C@@]1(C)[H])[H])[H]
SPLASH splash10-014i-0900000000-a838f5390f50e07570c7
Source of Spectrum J-50-2631-18
Wiley ID 1177510