CID 15939655

Delta(6)-protoilludene

Structural Information

Molecular Formula
C15H24
SMILES
CC1=C2CC[C@@]2([C@H]3CC(C[C@H]3C1)(C)C)C
InChI
InChI=1S/C15H24/c1-10-7-11-8-14(2,3)9-13(11)15(4)6-5-12(10)15/h11,13H,5-9H2,1-4H3/t11-,13+,15+/m1/s1
InChIKey
FBSBGGJQVUYUDB-ZLDLUXBVSA-N
Compound name
(4aS,7aS,7bR)-3,6,6,7b-tetramethyl-2,4,4a,5,7,7a-hexahydro-1H-cyclobuta[e]indene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

27
Patents

204.1878 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.19508 148.0
[M+Na]+ 227.17702 154.7
[M+NH4]+ 222.22162 157.6
[M+K]+ 243.15096 147.2
[M-H]- 203.18052 148.3
[M+Na-2H]- 225.16247 151.2
[M]+ 204.18725 148.3
[M]- 204.18835 148.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe