Acetic acid, 2-methylphenyl ester
- Formula: C9H10O2
- Molecular weight: 150.1745
- IUPAC Standard InChI: InChI=1S/C9H10O2/c1-7-5-3-4-6-9(7)11-8(2)10/h3-6H,1-2H3
- IUPAC Standard InChIKey: AMZORBZSQRUXNC-UHFFFAOYSA-N
- CAS Registry Number: 533-18-6
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Acetic acid, o-tolyl ester; o-Acetoxytoluene; o-Cresol acetate; o-Cresyl acetate; o-Cresylic acetate; o-Methylphenyl acetate; o-Tolyl acetate; Acetyl-o-cresol; 2-Methylphenyl acetate; 2-Methylphenyl ester of acetic acid; 2-Acetoxytoluene; NSC 58961
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
Van Den Dool and Kratz RI, non-polar column, custom temperature program
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
| Column type | Capillary | Packed |
|---|---|---|
| Active phase | BPX-5 | SE-30 |
| Column length (m) | 30. | 3.05 |
| Carrier gas | ||
| Substrate | Supelcoport; Chromosorb | |
| Column diameter (mm) | 0.25 | |
| Phase thickness (μm) | 0.25 | |
| Program | 35C(5min) => 3C/min => 210C => 40C/min => 240C (4min) | 40C(5min) => 10C/min => 200C or 250C (60min) |
| I | 1109. | 1122. |
| Reference | Cardeal, da Silva, et al., 2006 | Peng, Ding, et al., 1988 |
| Comment | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Cardeal, da Silva, et al., 2006
Cardeal, Z.L.; da Silva, M.D.R.G.; Marriott, P.J.,
Comprehensive two-dimensional gas chromatography/mass spectrometric analysis of pepper volatiles,
Rapid Commun. Mass Spectrom., 2006, 20, 19, 2823-2836, https://doi.org/10.1002/rcm.2665
. [all data]
Peng, Ding, et al., 1988
Peng, C.T.; Ding, S.F.; Hua, R.L.; Yang, Z.C.,
Prediction of Retention Indexes I. Structure-Retention Index Relationship on Apolar Columns,
J. Chromatogr., 1988, 436, 137-172, https://doi.org/10.1016/S0021-9673(00)94575-8
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.
© 2026 by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved.
Copyright for NIST Standard Reference Data is governed by the Standard Reference Data Act.