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

*Links on SpectraBase are not permalinks.
2-(9-phenanthrenyl)acetic acid
SpectraBase Compound ID CAhrg0yMrXU
InChI InChI=1S/C16H12O2/c17-16(18)10-12-9-11-5-1-2-6-13(11)15-8-4-3-7-14(12)15/h1-9H,10H2,(H,17,18)
InChIKey LVQRNIHYWJWRMN-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C16H12O2
Exact Mass 236.08373 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 Dd2jMvunWKm
Name 2-(9-phenanthrenyl)acetic acid
Alternate Name(s) 2-(9-phenanthryl)acetic acid 2-phenanthren-9-ylacetic acid 2-phenanthren-9-ylethanoic acid
CAS Registry Number 25177-46-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2
InChI InChI=1S/C16H12O2/c17-16(18)10-12-9-11-5-1-2-6-13(11)15-8-4-3-7-14(12)15/h1-9H,10H2,(H,17,18)
InChIKey LVQRNIHYWJWRMN-UHFFFAOYSA-N
Molecular Weight 236.270 g/mol
SMILES OC(Cc1c2c(cccc2)c2c(c1)cccc2)=O
SPLASH splash10-000f-0950000000-47edde3c1bc2d95b4430
Source of Spectrum J-50-4645-16
Wiley ID 1238918