CID 200279

1486-83-5

Structural Information

Molecular Formula
C12H25NO
SMILES
CCC1(C(C(C1O)(C)C)N(C)C)CC
InChI
InChI=1S/C12H25NO/c1-7-12(8-2)9(13(5)6)11(3,4)10(12)14/h9-10,14H,7-8H2,1-6H3
InChIKey
ZBUDHVXAJJWVIL-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-2,2-diethyl-4,4-dimethylcyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.19362 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.200896 150.2
[M+Na]+ 222.182838 156.4
[M-H]- 198.186344 154.4
[M+NH4]+ 217.227443 167.4
[M+K]+ 238.156778 158.7
[M+H-H2O]+ 182.190880 142.6
[M+HCOO]- 244.191821 170.2
[M+CH3COO]- 258.207471 196.6
[M+Na-2H]- 220.168286 152.9
[M]+ 199.19307142 161.0
[M]- 199.19416858 161.0
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.