CID 101408299

(3r)-3-amino-6-(aminomethyl)-3,4-dihydro-2h-pyran-2-ol

Structural Information

Molecular Formula
C6H12N2O2
SMILES
C1C=C(OC([C@@H]1N)O)CN
InChI
InChI=1S/C6H12N2O2/c7-3-4-1-2-5(8)6(9)10-4/h1,5-6,9H,2-3,7-8H2/t5-,6?/m1/s1
InChIKey
GBOGEEQLPKNDRP-LWOQYNTDSA-N
Compound name
(3R)-3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.08987 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.097146 130.0
[M+Na]+ 167.079088 136.3
[M-H]- 143.082594 132.1
[M+NH4]+ 162.123693 148.6
[M+K]+ 183.053028 135.7
[M+H-H2O]+ 127.087130 124.3
[M+HCOO]- 189.088071 151.3
[M+CH3COO]- 203.103721 175.4
[M+Na-2H]- 165.064536 135.1
[M]+ 144.08932142 124.8
[M]- 144.09041858 124.8
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.