CID 155858592

2580185-12-0

Structural Information

Molecular Formula
C8H15NO
SMILES
CC1(C2CC1(OC2)CN)C
InChI
InChI=1S/C8H15NO/c1-7(2)6-3-8(7,5-9)10-4-6/h6H,3-5,9H2,1-2H3
InChIKey
XOLUTZKRJMZUJQ-UHFFFAOYSA-N
Compound name
(5,5-dimethyl-2-oxabicyclo[2.1.1]hexan-1-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

141.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 136.2
[M+Na]+ 164.10459 143.4
[M-H]- 140.10809 138.2
[M+NH4]+ 159.14919 160.7
[M+K]+ 180.07853 145.0
[M+H-H2O]+ 124.11263 130.7
[M+HCOO]- 186.11357 154.3
[M+CH3COO]- 200.12922 181.9
[M+Na-2H]- 162.09004 145.1
[M]+ 141.11482 148.8
[M]- 141.11592 148.8
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.