CID 155978331

(1r,4r)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-amine hydrochloride

Structural Information

Molecular Formula
C7H13NO
SMILES
C[C@@]12CC[C@@](C1)(CO2)N
InChI
InChI=1S/C7H13NO/c1-6-2-3-7(8,4-6)5-9-6/h2-5,8H2,1H3/t6-,7-/m1/s1
InChIKey
OIQYPAWFNAOGKM-RNFRBKRXSA-N
Compound name
(1R,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

127.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 125.2
[M+Na]+ 150.08894 133.2
[M+NH4]+ 145.13354 137.8
[M+K]+ 166.06288 128.2
[M-H]- 126.09244 127.3
[M+Na-2H]- 148.07439 129.8
[M]+ 127.09917 127.0
[M]- 127.10027 127.0
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.