| SpectraBase Spectrum ID |
GRhZzzulVvD |
| Name |
Phthalic acid, isobutyl 2H-octahydroquinazoline-1-methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.225308478 u |
| Formula |
C22H31NO4 |
| InChI |
InChI=1S/C22H31NO4/c1-16(2)14-26-21(24)18-9-3-4-10-19(18)22(25)27-15-17-8-7-13-23-12-6-5-11-20(17)23/h3-4,9-10,16-17,20H,5-8,11-15H2,1-2H3 |
| InChIKey |
ORTNZUBEGOJVTC-UHFFFAOYSA-N |
| Molecular Weight |
373.493 g/mol |
| SMILES |
C(C1=C(C=CC=C1)C(OCC1C2N(CCCC2)CCC1)=O)(OCC(C)C)=O |
