SpectraBase Spectrum ID |
8JlhgEV09i4 |
Name |
Phthalamide acid |
CAS Registry Number |
88-97-1 |
Classification |
Chemical |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
165.042593086 u |
Formula |
C8H7NO3 |
InChI |
InChI=1S/C8H7NO3/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H2,9,10)(H,11,12) |
InChIKey |
CYMRPDYINXWJFU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
165.148 g/mol |
Nominal Mass |
165 u |
Quality |
973 |
Retention Index |
1259 |
SMILES |
OC(C=1C(C(=O)N)=CC=CC1)=O |
SPLASH |
splash10-0udi-9800000000-a562003772efd9cc5bed |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-Carbamoylbenzoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_018363 |