CID 166368

72928-44-0

Structural Information

Molecular Formula

C₁₄H₂₄O

SMILES

CC1(CCCC2=C1CC(CC2)(C)CO)C

InChI

InChI=1S/C14H24O/c1-13(2)7-4-5-11-6-8-14(3,10-15)9-12(11)13/h15H,4-10H2,1-3H3

InChIKey

CQGAXKIQOCMVDN-UHFFFAOYSA-N

Compound name

(2,8,8-trimethyl-1,3,4,5,6,7-hexahydronaphthalen-2-yl)methanol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 8
Patents: 208.18271 Da
Monoisotopic Mass: 3.1
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]+	209.18999	150.1
[M+Na]+	231.17193	156.1
[M-H]-	207.17543	152.7
[M+NH4]+	226.21653	173.6
[M+K]+	247.14587	153.1
[M+H-H2O]+	191.17997	145.4
[M+HCOO]-	253.18091	165.7
[M+CH3COO]-	267.19656	186.2
[M+Na-2H]-	229.15738	155.1
[M]+	208.18216	145.7
[M]-	208.18326	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe