CID 32241

2,6-diisopropylnaphthalene

Structural Information

Molecular Formula
C16H20
SMILES
CC(C)C1=CC2=C(C=C1)C=C(C=C2)C(C)C
InChI
InChI=1S/C16H20/c1-11(2)13-5-7-16-10-14(12(3)4)6-8-15(16)9-13/h5-12H,1-4H3
InChIKey
GWLLTEXUIOFAFE-UHFFFAOYSA-N
Compound name
2,6-di(propan-2-yl)naphthalene
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

18
References

1668
Patents

212.1565 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.16378 149.8
[M+Na]+ 235.14572 164.5
[M+NH4]+ 230.19032 160.1
[M+K]+ 251.11966 156.2
[M-H]- 211.14922 154.0
[M+Na-2H]- 233.13117 157.3
[M]+ 212.15595 153.4
[M]- 212.15705 153.4
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