CID 87186

17610-24-1

Structural Information

Molecular Formula

C₁₇H₂₄O

SMILES

CC1=CC2=C(C=C1C(=O)C)C(CCC2(C)C)(C)C

InChI

InChI=1S/C17H24O/c1-11-9-14-15(10-13(11)12(2)18)17(5,6)8-7-16(14,3)4/h9-10H,7-8H2,1-6H3

InChIKey

QZADYGNSQCABPT-UHFFFAOYSA-N

Compound name

1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethanone

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 107
Patents: 244.18271 Da
Monoisotopic Mass: 5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	245.18999	157.7
[M+Na]+	267.17193	171.3
[M+NH4]+	262.21653	169.9
[M+K]+	283.14587	160.0
[M-H]-	243.17543	161.1
[M+Na-2H]-	265.15738	165.7
[M]+	244.18216	161.1
[M]-	244.18326	161.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe