| SpectraBase Spectrum ID |
L6V6D9OvxaG |
| Name |
Methyl 12-(Phenyl)aminodehydroabietate |
| Appearance |
Amorphous white solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.266779369 u |
| Formula |
C27H35NO2 |
| InChI |
InChI=1S/C27H35NO2/c1-18(2)21-16-19-12-13-24-26(3,14-9-15-27(24,4)25(29)30-5)22(19)17-23(21)28-20-10-7-6-8-11-20/h6-8,10-11,16-18,24,28H,9,12-15H2,1-5H3/t24-,26-,27-/m1/s1 |
| InChIKey |
OGMPBBNUQSXCFW-ZRJLEYOISA-N |
| Instrument Name |
Kratos MS 25RF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np000501y |
| Molecular Weight |
405.582 g/mol |
| SMILES |
N(C1=CC=CC=C1)C1=C(C=C2C(=C1)[C@@]1([C@@](CC2)([C@](CCC1)(C)C(=O)OC)[H])C)C(C)C |
| SPLASH |
splash10-0a4i-0001900000-177b8e575c2c96fc8aeb |
| Source of Spectrum |
G4-64-766-21 (DOI: 10.1021/np000501y) |
| Wiley ID |
1892565 |
