| SpectraBase Spectrum ID |
3lJQTIotiIm |
| Name |
1H-Indole-3-acetic acid, 1-methyl- |
| CAS Registry Number |
1912-48-7 |
| Comments |
Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C11H13NO2 - which differs from the formula reported for the mass spectrum (C11H11NO2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H11NO2 |
| InChI |
InChI=1S/C11H13NO2/c1-12-7-8(6-11(13)14)9-4-2-3-5-10(9)12/h2-5,7,10,12H,6H2,1H3,(H,13,14) |
| InChIKey |
PMODVNWALLWVAY-UHFFFAOYSA-N |
| Molecular Weight |
191.230 g/mol |
| SMILES |
OC(=O)CC1=C2C(C=CC=C2)N(=C1)C |
| SPLASH |
splash10-0006-0900000000-3a84287efaa49ebb5de4 |
| Source of Spectrum |
F-41-5233-15 |
| Synonyms |
Indole-3-acetic acid, 1-methyl-
(1-methyl-7aH-1lambda(5)-indol-3-yl)acetic acid
1-Methylindole-3-acetic acid
1-Methylindolyl-3-acetic acid
N-Methylindole-3-acetic acid
N-Methylindoleacetic acid
NSC 78007 |
| Wiley ID |
1185678 |
