CID 534931

88644-30-8

Structural Information

Molecular Formula

C₁₅H₂₆O

SMILES

CC1(CCCC2(C13CCC(C3)C2(C)C)O)C

InChI

InChI=1S/C15H26O/c1-12(2)7-5-8-15(16)13(3,4)11-6-9-14(12,15)10-11/h11,16H,5-10H2,1-4H3

InChIKey

CCMWYZQSEJEAEY-UHFFFAOYSA-N

Compound name

2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 23
Patents: 222.19836 Da
Monoisotopic Mass: 4.0
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]+	223.20564	154.3
[M+Na]+	245.18758	162.6
[M-H]-	221.19108	157.5
[M+NH4]+	240.23218	185.7
[M+K]+	261.16152	157.9
[M+H-H2O]+	205.19562	151.3
[M+HCOO]-	267.19656	169.4
[M+CH3COO]-	281.21221	166.6
[M+Na-2H]-	243.17303	158.4
[M]+	222.19781	152.0
[M]-	222.19891	152.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe