SpectraBase Spectrum ID |
Hmak4IKdsr9 |
Name |
[3ar-(3A.alpha.,6.alpha.,8A.alpha.)]-4,5,6,7,8,8A-hexahydro-3,7,7-trimethyl-8-methylene-1H-3A,6-methanoazulene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
202.172150708 u |
Formula |
C15H22 |
InChI |
InChI=1S/C15H22/c1-10-5-6-13-11(2)14(3,4)12-7-8-15(10,13)9-12/h5,12-13H,2,6-9H2,1,3-4H3/t12-,13-,15+/m1/s1 |
InChIKey |
HTWIWKAEPWTHMH-NFAWXSAZSA-N |
Molecular Weight |
202.341 g/mol |
SMILES |
[C@@]123[C@@](C(=C)C([C@](C3)([H])CC1)(C)C)(CC=C2C)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840448 |