CID 42078860

2248202-39-1

Structural Information

Molecular Formula
C11H16N2O
SMILES
C1CO[C@H](CN1C2=CC=CC=C2)CN
InChI
InChI=1S/C11H16N2O/c12-8-11-9-13(6-7-14-11)10-4-2-1-3-5-10/h1-5,11H,6-9,12H2/t11-/m0/s1
InChIKey
YAKKATWFMLCGMI-NSHDSACASA-N
Compound name
[(2S)-4-phenylmorpholin-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.12627 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.13355 143.3
[M+Na]+ 215.11549 148.3
[M-H]- 191.11899 148.0
[M+NH4]+ 210.16009 159.2
[M+K]+ 231.08943 146.6
[M+H-H2O]+ 175.12353 135.2
[M+HCOO]- 237.12447 162.8
[M+CH3COO]- 251.14012 183.9
[M+Na-2H]- 213.10094 149.4
[M]+ 192.12572 138.2
[M]- 192.12682 138.2
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.