SpectraBase Spectrum ID |
2mvAWrpb2VE |
Name |
3,4-Methylenedioxyphenylmethanol |
CAS Registry Number |
495-76-1 |
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 |
152.047344115 u |
Formula |
C8H8O3 |
InChI |
InChI=1S/C8H8O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3,9H,4-5H2 |
InChIKey |
BHUIUXNAPJIDOG-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
152.149 g/mol |
Nominal Mass |
152 u |
Quality |
988 |
Retention Index |
1141 |
SMILES |
OCC=1C=C2C(=CC1)OCO2 |
SPLASH |
splash10-0udi-8900000000-5d34ba0e652a5cc27f81 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1,3-Benzodioxole-5-methanol |
Technique |
GC/MS |
Wiley ID |
DD2024_002233 |