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Cyclohept[b]indol-6(5H)-one, 9-[(dimethylamino)methyl]-7,8,9,10-tetrahydro-9-hydroxy-8-(1-methylen e-2-propenyl)-, (8S-trans)-
SpectraBase Compound ID BVDzGfn9uEC
InChI InChI=1S/C21H26N2O2/c1-5-14(2)17-10-19(25)20-16(11-21(17,13-24)12-23(3)4)15-8-6-7-9-18(15)22-20/h5-9,17,22,24H,1-2,10-13H2,3-4H3
InChIKey WZMVRPPTVVCMTN-UHFFFAOYSA-N
Mol Weight 338.45 g/mol
Molecular Formula C21H26N2O2
Exact Mass 338.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AISGoDSfyHp
Name Cyclohept[b]indol-6(5H)-one, 9-[(dimethylamino)methyl]-7,8,9,10-tetrahydro-9-hydroxy-8-(1-methylen e-2-propenyl)-, (8S-trans)-
CAS Registry Number 33228-83-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O2
InChI InChI=1S/C21H26N2O2/c1-5-14(2)17-10-19(25)20-16(11-21(17,13-24)12-23(3)4)15-8-6-7-9-18(15)22-20/h5-9,17,22,24H,1-2,10-13H2,3-4H3
InChIKey WZMVRPPTVVCMTN-UHFFFAOYSA-N
Molecular Weight 338.451 g/mol
SMILES [nH]1c2c(c3CC(CO)(C(CC(c13)=O)C(C=C)=C)CN(C)C)cccc2
SPLASH splash10-0a4i-9001000000-53ff1311184d6ba8d2f0
Source of Spectrum B-28-1840-0
Synonyms 9-[(dimethylamino)methyl]-9-(hydroxymethyl)-8-(1-methylene-2-propenyl)-7,8,9,10-tetrahydrocyclohepta[b]indol-6(5H)-one Cyclohept[b]indol-6(5H)-one, 9-[(dimethylamino)methyl]-7,8,9,10-tetrahydro-9-(hydroxymethyl)-8-(1- methyleneallyl)-, (+)- Ervataminol methine Indolo-3-(1',3'-butadien-2'-yl)-3-(dimethylamino)methyl-3-hydroxymethyl heptanone
Wiley ID 1334056