| SpectraBase Spectrum ID |
IHKBhcGVtpd |
| Name |
1,3a-Ethano-1,3a-dihydropyrene |
| Alternate Name(s) |
pentacyclo[6.6.2.2(1,4).0(5,15).0(12,16)]octadeca-2,5(15),6,8(16),9,11,13-heptaene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14 |
| InChI |
InChI=1S/C18H14/c1-2-13-4-5-15-12-6-9-18(10-7-12)11-8-14(3-1)16(13)17(15)18/h1-6,8-9,11-12H,7,10H2 |
| InChIKey |
JHDSZWVPVFWPSK-UHFFFAOYSA-N |
| Molecular Weight |
230.310 g/mol |
| SMILES |
c12C34C=Cc5c2c(ccc1C(C=C4)CC3)ccc5 |
| SPLASH |
splash10-0udi-0090000000-f3f773b348ed9c8938a0 |
| Source of Spectrum |
KC-0-1494-3 |
| Wiley ID |
821798 |
