CID 5276210

Amino(methyl)[?]ol

Structural Information

Molecular Formula
C14H25NO
SMILES
CC1C2CCCC([C@@H]2N)[C@]3(C1CCCC3)O
InChI
InChI=1S/C14H25NO/c1-9-10-5-4-7-12(13(10)15)14(16)8-3-2-6-11(9)14/h9-13,16H,2-8,15H2,1H3/t9?,10?,11?,12?,13-,14+/m1/s1
InChIKey
DNQNIARBWUTCEW-RXENIJKDSA-N
Compound name
(2S,13R)-13-amino-8-methyltricyclo[7.3.1.02,7]tridecan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

223.19362 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.20090 153.1
[M+Na]+ 246.18284 156.9
[M-H]- 222.18634 153.5
[M+NH4]+ 241.22744 174.8
[M+K]+ 262.15678 152.8
[M+H-H2O]+ 206.19088 147.6
[M+HCOO]- 268.19182 164.0
[M+CH3COO]- 282.20747 162.6
[M+Na-2H]- 244.16829 156.7
[M]+ 223.19307 143.4
[M]- 223.19417 143.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.