| SpectraBase Spectrum ID |
DAaKtP2lAEI |
| Name |
6H-[1]Benzopyrano[3',4':4,5]pyrrolo[1,2-B]isoquinoline, 7A,8,13,14A-tetrahydro-, trans- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.131014170 u |
| Formula |
C19H17NO |
| InChI |
InChI=1S/C19H17NO/c1-2-6-14-11-20-16(9-13(14)5-1)10-15-12-21-18-8-4-3-7-17(18)19(15)20/h1-8,10,16,19H,9,11-12H2/t16-,19+/m0/s1 |
| InChIKey |
WUXVWYRNJZHUCQ-QFBILLFUSA-N |
| Molecular Weight |
275.351 g/mol |
| SMILES |
[C@@]12(N3[C@](C=C2COC=2C1=CC=CC2)(CC1=C(C3)C=CC=C1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844984 |
![6H-[1]Benzopyrano[3',4':4,5]pyrrolo[1,2-b]isoquinoline, 7a,8,13,14a-tetrahydro-, trans-](/api/spectrum/DAaKtP2lAEI/structure.png?h=300&w=458 "6H-[1]Benzopyrano[3',4':4,5]pyrrolo[1,2-b]isoquinoline, 7a,8,13,14a-tetrahydro-, trans-")
