CID 3010316

Cyclopropa[d]naphthalene-7-methanol, decahydro-a,a,4a-trimethyl-

Structural Information

Molecular Formula
C15H26O
SMILES
CC12CCCC3C1(C3)CC(CC2)C(C)(C)O
InChI
InChI=1S/C15H26O/c1-13(2,16)11-6-8-14(3)7-4-5-12-10-15(12,14)9-11/h11-12,16H,4-10H2,1-3H3
InChIKey
DRZJMHNJQWFIES-UHFFFAOYSA-N
Compound name
2-(4a-methyl-1a,2,3,4,5,6,7,8-octahydro-1H-cyclopropa[j]naphthalen-7-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

222.19836 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.20564 156.6
[M+Na]+ 245.18758 162.9
[M-H]- 221.19108 160.9
[M+NH4]+ 240.23218 174.9
[M+K]+ 261.16152 160.9
[M+H-H2O]+ 205.19562 152.1
[M+HCOO]- 267.19656 168.4
[M+CH3COO]- 281.21221 191.9
[M+Na-2H]- 243.17303 162.6
[M]+ 222.19781 154.6
[M]- 222.19891 154.6
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

No patent data available for this compound.