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1H-Indole, 3-[(3,4-dimethyl-1-nitro-3-cyclohexen-1-yl)methyl]-1-methyl-
SpectraBase Compound ID Jgq98itBgGa
InChI InChI=1S/C18H22N2O2/c1-13-8-9-18(20(21)22,10-14(13)2)11-15-12-19(3)17-7-5-4-6-16(15)17/h4-7,12H,8-11H2,1-3H3
InChIKey SXJGVNRLGMTFON-UHFFFAOYSA-N
Mol Weight 298.39 g/mol
Molecular Formula C18H22N2O2
Exact Mass 298.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lWZnIdyOIU
Name 1H-Indole, 3-[(3,4-dimethyl-1-nitro-3-cyclohexen-1-yl)methyl]-1-methyl-
Alternate Name(s) 3-(3',4',-Dimethyl-1'-nitro-3'-cyclohexenyl)methyl-N-methylindole 3-[(3,4-dimethyl-1-nitro-3-cyclohexen-1-yl)methyl]-1-methyl-1H-indole
CAS Registry Number 90059-96-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O2
InChI InChI=1S/C18H22N2O2/c1-13-8-9-18(20(21)22,10-14(13)2)11-15-12-19(3)17-7-5-4-6-16(15)17/h4-7,12H,8-11H2,1-3H3
InChIKey SXJGVNRLGMTFON-UHFFFAOYSA-N
Molecular Weight 298.386 g/mol
SMILES c1(c[n](C)c2c1cccc2)CC1(N(=O)=O)CC(C)=C(CC1)C
SPLASH splash10-0006-2900000000-08f51adce44be945aa2a
Source of Spectrum H-67-280-0
Wiley ID 1301153