CID 64270

27866-21-3

Structural Information

Molecular Formula
C20H37NO2
SMILES
CC(C)N(CC(COCC12CC3CC(C1)CC(C3)C2)O)C(C)C
InChI
InChI=1S/C20H37NO2/c1-14(2)21(15(3)4)11-19(22)12-23-13-20-8-16-5-17(9-20)7-18(6-16)10-20/h14-19,22H,5-13H2,1-4H3
InChIKey
YGXKWCVOKQHWRC-UHFFFAOYSA-N
Compound name
1-(1-adamantylmethoxy)-3-[di(propan-2-yl)amino]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

323.28244 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.28972 188.4
[M+Na]+ 346.27166 184.8
[M-H]- 322.27516 181.4
[M+NH4]+ 341.31626 208.5
[M+K]+ 362.24560 183.2
[M+H-H2O]+ 306.27970 181.9
[M+HCOO]- 368.28064 189.7
[M+CH3COO]- 382.29629 222.8
[M+Na-2H]- 344.25711 191.3
[M]+ 323.28189 189.5
[M]- 323.28299 189.5
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

patents stripe