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

*Links on SpectraBase are not permalinks.
2C-IP N,N-bis(3-trifluoromethylbenzyl)
SpectraBase Compound ID FeZnKGgeEko
InChI InChI=1S/C29H31F6NO2/c1-19(2)25-16-26(37-3)22(15-27(25)38-4)11-12-36(17-20-7-5-9-23(13-20)28(30,31)32)18-21-8-6-10-24(14-21)29(33,34)35/h5-10,13-16,19H,11-12,17-18H2,1-4H3
InChIKey LDDPPFRVNDMJGG-UHFFFAOYSA-N
Mol Weight 539.56 g/mol
Molecular Formula C29H31F6NO2
Exact Mass 539.225898 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 AwkzLCHpjRF
Name 2C-IP N,N-bis(3-trifluoromethylbenzyl)
Classification Phenethylamine designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 539.225898218 u
Formula C29H31F6NO2
InChI InChI=1S/C29H31F6NO2/c1-19(2)25-16-26(37-3)22(15-27(25)38-4)11-12-36(17-20-7-5-9-23(13-20)28(30,31)32)18-21-8-6-10-24(14-21)29(33,34)35/h5-10,13-16,19H,11-12,17-18H2,1-4H3
InChIKey LDDPPFRVNDMJGG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 539.562 g/mol
Nominal Mass 539 u
Quality 988
Retention Index 2684
SMILES C=1(C(=CC(=C(C1)OC)C(C)C)OC)CCN(CC=1C=C(C(F)(F)F)C=CC1)CC=1C=C(C(F)(F)F)C=CC1
SPLASH splash10-052b-0809000000-ee5142b520669468f3bc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-trifluoromethylbenzyl)-2,5-dimethoxy-4-isopropylphenethylamine 1-(4-methoxy-2,3-dimethylphenyl)-N-(3-(trifluoromethyl)benzyl)propan-2-amine
Technique GC/MS
Wiley ID DD2024_020943