CID 102750

2084-69-7

Structural Information

Molecular Formula
C16H24
SMILES
CC1CC(C2=C(C1(C)C)C=C(C=C2)C)(C)C
InChI
InChI=1S/C16H24/c1-11-7-8-13-14(9-11)16(5,6)12(2)10-15(13,3)4/h7-9,12H,10H2,1-6H3
InChIKey
JIVANURAWUCQIG-UHFFFAOYSA-N
Compound name
1,1,2,4,4,7-hexamethyl-2,3-dihydronaphthalene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

245
Patents

216.1878 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.19508 150.8
[M+Na]+ 239.17702 165.3
[M+NH4]+ 234.22162 164.2
[M+K]+ 255.15096 153.1
[M-H]- 215.18052 155.2
[M+Na-2H]- 237.16247 159.9
[M]+ 216.18725 154.8
[M]- 216.18835 154.8
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