SpectraBase Spectrum ID |
2Mrx2H1hsk8 |
Name |
1-(1,5-DIMETHYLHEXYL)-13A,15A-DIMETHYL-11-NITRO-2,3,3A,3B,4,5,5A,6,13,13A,13B,14,15,15A-TETRADECAHYDRO-1H-INDENO[5,4-A]NAPHTHACENE |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
515.376329820 u |
Formula |
C35H49NO2 |
InChI |
InChI=1S/C35H49NO2/c1-22(2)8-6-9-23(3)30-14-15-31-28-13-12-27-19-25-18-24-10-7-11-33(36(37)38)29(24)20-26(25)21-35(27,5)32(28)16-17-34(30,31)4/h7,10-11,18,20,22-23,27-28,30-32H,6,8-9,12-17,19,21H2,1-5H3 |
InChIKey |
JEXDYQHNFKXLFP-UHFFFAOYSA-N |
Molecular Weight |
515.782 g/mol |
Nominal Mass |
515 u |
Number of Peaks |
336 |
SMILES |
C12C(CCC3Cc4cc5cccc(c5cc4CC13C)N(=O)=O)C1CCC(C1(CC2)C)C(CCCC(C)C)C |
SPLASH |
splash10-066u-9542020000-8f0f18de462add61ddd1 |
Source File Reference |
LMCM-20133-551G |
Synonyms |
14,18-dimethyl-19-(6-methylheptan-2-yl)-9-nitrohexacyclo[12.11.0.0(3,12).0(5,10).0(15,23).0(18,22)]pentacosa-3(12),4,6,8,10-pentaene |
Wiley ID |
8_8191 |