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

*Links on SpectraBase are not permalinks.
5-IT
SpectraBase Compound ID CpG6iG7n1Hn
InChI InChI=1S/C11H14N2/c1-8(12)6-9-2-3-11-10(7-9)4-5-13-11/h2-5,7-8,13H,6,12H2,1H3
InChIKey AULGMISRJWGTBA-UHFFFAOYSA-N
Mol Weight 174.25 g/mol
Molecular Formula C11H14N2
Exact Mass 174.115698 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 KRWxErBkT53
Name 5-APIN
CAS Registry Number 3784-30-3
Classification 5-Aminoethyindol designer drug
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 174.115698459 u
Formula C11H14N2
InChI InChI=1S/C11H14N2/c1-8(12)6-9-2-3-11-10(7-9)4-5-13-11/h2-5,7-8,13H,6,12H2,1H3
InChIKey AULGMISRJWGTBA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 174.247 g/mol
Nominal Mass 174 u
Quality 989
Retention Index 1735
SMILES NC(CC1=CC2=C(NC=C2)C=C1)C
SPLASH splash10-000x-9800000000-94da9f3fc07f379315e8
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-API 5-(2-Aminopropyl)indole 5-IT 2-(1H-Indol-5-yl)-1-methyl-ethylamine
Technique GC/MS
Wiley ID DD2024_021250