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

*Links on SpectraBase are not permalinks.
Aristolochic Acid I
SpectraBase Compound ID ExcDwLUhL7I
InChI InChI=1S/C17H11NO7/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13/h2-6H,7H2,1H3,(H,19,20)
InChIKey BBFQZRXNYIEMAW-UHFFFAOYSA-N
Mol Weight 341.28 g/mol
Molecular Formula C17H11NO7
Exact Mass 341.053552 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 5u9hdWMy7Za
Name 3,4-Methylenedioxy-8-methoxy-10-nitro-1-phenanthrenecarboxylic acid
Alternate Name(s) Phenanthro[3,4-d]-1,3-dioxole-5-carboxylic acid, 8-methoxy-6-nitro- 8-Methoxy-3,4-methylendioxxy-10-nitro-1-phenanthrencarbonsaeure 8-Methoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid 8-Methoxy-3,4-methylenedioxy-10-nitrophenanthrene-1-carboxylic acid Aristolochic acid A 8-Methoxy-6-nitro-naphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid 8-Methoxy-6-nitrophenanthol (3,4-d) 1,3-dioxole-5-carboxylic acid Aristolochic acid I Aristolochiazaeure Aristolochic acid Aristolochin Aristolochine Birthwort Phenanthro[3,4-d]-1,3-dioxole-5-carBOCylic acid, 8-methoxy-6-nitro- Tardolyt BRN 0345159 CCRIS 1544 EINECS 206-238-3 NSC 11926 TR 1736
CAS Registry Number 313-67-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11NO7
InChI InChI=1S/C17H11NO7/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13/h2-6H,7H2,1H3,(H,19,20)
InChIKey BBFQZRXNYIEMAW-UHFFFAOYSA-N
Molecular Weight 341.275 g/mol
SMILES OC(c1c2c(N(=O)=O)cc3c(cccc3OC)c2c2OCOc2c1)=O
SPLASH splash10-0002-9062000000-237233e7dc70fc0af826
Source of Spectrum X2-45-658-4
Wiley ID 1601052