CID 174766

2-naphthalenecarboxaldehyde, 5,6,7,8-tetrahydro-1-methoxy-3,5,5,8,8-pentamethyl-

Structural Information

Molecular Formula
C17H24O2
SMILES
CC1=CC2=C(C(=C1C=O)OC)C(CCC2(C)C)(C)C
InChI
InChI=1S/C17H24O2/c1-11-9-13-14(15(19-6)12(11)10-18)17(4,5)8-7-16(13,2)3/h9-10H,7-8H2,1-6H3
InChIKey
WPUPOYSDTDHCGJ-UHFFFAOYSA-N
Compound name
1-methoxy-3,5,5,8,8-pentamethyl-6,7-dihydronaphthalene-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

20
Patents

260.17764 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.18492 160.1
[M+Na]+ 283.16686 173.9
[M+NH4]+ 278.21146 171.9
[M+K]+ 299.14080 162.6
[M-H]- 259.17036 163.2
[M+Na-2H]- 281.15231 167.9
[M]+ 260.17709 163.5
[M]- 260.17819 163.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe