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4-HTMPIPO

View entire compound with spectra: 1 MS (GC)

4-HTMPIPO
SpectraBase Compound ID JG5AXSq3tD0
InChI InChI=1S/C21H31NO2/c1-6-7-10-13-22-15-17(16-11-8-9-12-18(16)22)19(23)14-20(2,3)21(4,5)24/h8-9,11-12,15,24H,6-7,10,13-14H2,1-5H3
InChIKey GWHGUYKAGQLPTQ-UHFFFAOYSA-N
Mol Weight 329.48 g/mol
Molecular Formula C21H31NO2
Exact Mass 329.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FnlqGxoIh8w
Name 4-HTMPIPO
Alternate Name(s) 4-Hydroxy-3,3,4-trimethyl-1-(1-pentyl-1H-indol-3-yl)pentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO2
InChI InChI=1S/C21H31NO2/c1-6-7-10-13-22-15-17(16-11-8-9-12-18(16)22)19(23)14-20(2,3)21(4,5)24/h8-9,11-12,15,24H,6-7,10,13-14H2,1-5H3
InChIKey GWHGUYKAGQLPTQ-UHFFFAOYSA-N
Molecular Weight 329.484 g/mol
SMILES OC(C(CC(=O)c1c[n](c2ccccc12)CCCCC)(C)C)(C)C
SPLASH splash10-0002-1391000000-d81c5714218cade4b00e
Source of Spectrum SWG-33-4208-0
Wiley ID 1810837